USER MOD reduce.3.24.130724 H: found=0, std=0, add=1560, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1558 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 154 THR OG1 : rot 180:sc= -0.972 USER MOD Set 1.2: A 155 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 86 CYS SG : rot 93:sc= 0.102 USER MOD Set 2.2: A 103 THR OG1 : rot 102:sc= 0.674 USER MOD Set 3.1: A 13 HIS :FLIP no HD1:sc= -0.235 F(o=0.11,f=0.83) USER MOD Set 3.2: A 16 SER OG : rot -48:sc= 1.06 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.0349 USER MOD Single : A 6 GLN : amide:sc= -1.12 K(o=-1.1,f=-1.9!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= -0.075 K(o=-0.075,f=-7.8!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.341 K(o=-0.34,f=-2.1!) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0.146 USER MOD Single : A 32 LYS NZ :NH3+ -161:sc= -0.122 (180deg=-0.631) USER MOD Single : A 33 ASN : amide:sc= -0.266 K(o=-0.27,f=-1.9!) USER MOD Single : A 39 SER OG : rot 104:sc= 1.28 USER MOD Single : A 45 LYS NZ :NH3+ -166:sc=-0.00183 (180deg=-0.0935) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= 0.58 K(o=0.58,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ -143:sc= 1.13 (180deg=-0.975) USER MOD Single : A 64 HIS : no HD1:sc= -0.404 K(o=-0.4,f=-2.5!) USER MOD Single : A 68 ASN : amide:sc= 0.827 K(o=0.83,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 CYS SG : rot 180:sc= -0.279 USER MOD Single : A 85 LYS NZ :NH3+ 162:sc= -0.398 (180deg=-0.661) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 159:sc= -0.0552 (180deg=-0.387) USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.0862 USER MOD Single : A 97 TYR OH : rot -100:sc= -1.56! USER MOD Single : A 98 GLN : amide:sc= -0.08 K(o=-0.08,f=-1.2!) USER MOD Single : A 109 LYS NZ :NH3+ 149:sc= -0.163 (180deg=-0.598) USER MOD Single : A 111 TYR OH : rot 100:sc= -3.55! USER MOD Single : A 115 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 117 THR OG1 : rot -176:sc= 1.04 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 TYR OH : rot -131:sc= 0.74 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 ASN : amide:sc= 0.177 K(o=0.18,f=-4.7!) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 ASN : amide:sc= -0.53 K(o=-0.53,f=-3.7!) USER MOD Single : A 139 GLN :FLIP amide:sc= -0.318 F(o=-1.4!,f=-0.32) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 THR OG1 : rot 79:sc= 0.0911 USER MOD Single : A 152 LYS NZ :NH3+ -155:sc= 1.3 (180deg=1.07) USER MOD Single : A 157 LYS NZ :NH3+ -170:sc= 1.15 (180deg=1.07) USER MOD Single : A 161 LYS NZ :NH3+ -169:sc= 1.15 (180deg=1.12) USER MOD Single : A 166 THR OG1 : rot 160:sc= 0.214 USER MOD Single : A 167 TYR OH : rot 180:sc= 0 USER MOD Single : A 171 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N LEU A 2 -12.685 -16.439 2.720 1.00 0.32 N ATOM 21 CA LEU A 2 -12.880 -15.887 1.390 1.00 0.29 C ATOM 22 C LEU A 2 -11.881 -16.490 0.428 1.00 0.25 C ATOM 23 O LEU A 2 -10.843 -16.985 0.839 1.00 0.26 O ATOM 24 CB LEU A 2 -12.759 -14.365 1.405 1.00 0.38 C ATOM 25 CG LEU A 2 -14.043 -13.623 1.786 1.00 0.51 C ATOM 26 CD1 LEU A 2 -14.311 -13.728 3.279 1.00 0.63 C ATOM 27 CD2 LEU A 2 -13.964 -12.169 1.362 1.00 0.62 C ATOM 0 HA LEU A 2 -13.887 -16.138 1.057 1.00 0.29 H new ATOM 0 HB2 LEU A 2 -11.972 -14.084 2.105 1.00 0.38 H new ATOM 0 HB3 LEU A 2 -12.442 -14.030 0.417 1.00 0.38 H new ATOM 0 HG LEU A 2 -14.873 -14.094 1.259 1.00 0.51 H new ATOM 0 HD11 LEU A 2 -15.229 -13.192 3.522 1.00 0.63 H new ATOM 0 HD12 LEU A 2 -14.418 -14.777 3.557 1.00 0.63 H new ATOM 0 HD13 LEU A 2 -13.478 -13.290 3.830 1.00 0.63 H new ATOM 0 HD21 LEU A 2 -14.885 -11.658 1.641 1.00 0.62 H new ATOM 0 HD22 LEU A 2 -13.119 -11.691 1.858 1.00 0.62 H new ATOM 0 HD23 LEU A 2 -13.830 -12.112 0.282 1.00 0.62 H new ATOM 39 N THR A 3 -12.221 -16.499 -0.838 1.00 0.24 N ATOM 40 CA THR A 3 -11.333 -17.024 -1.850 1.00 0.22 C ATOM 41 C THR A 3 -10.597 -15.881 -2.526 1.00 0.20 C ATOM 42 O THR A 3 -10.967 -14.718 -2.350 1.00 0.20 O ATOM 43 CB THR A 3 -12.108 -17.843 -2.897 1.00 0.24 C ATOM 44 OG1 THR A 3 -13.505 -17.529 -2.819 1.00 0.40 O ATOM 45 CG2 THR A 3 -11.901 -19.336 -2.683 1.00 0.42 C ATOM 0 H THR A 3 -13.110 -16.147 -1.194 1.00 0.24 H new ATOM 0 HA THR A 3 -10.614 -17.686 -1.367 1.00 0.22 H new ATOM 0 HB THR A 3 -11.730 -17.584 -3.886 1.00 0.24 H new ATOM 0 HG1 THR A 3 -13.995 -18.051 -3.488 1.00 0.40 H new ATOM 0 HG21 THR A 3 -12.459 -19.892 -3.436 1.00 0.42 H new ATOM 0 HG22 THR A 3 -10.840 -19.572 -2.769 1.00 0.42 H new ATOM 0 HG23 THR A 3 -12.255 -19.614 -1.690 1.00 0.42 H new ATOM 53 N LEU A 4 -9.557 -16.203 -3.279 1.00 0.19 N ATOM 54 CA LEU A 4 -8.779 -15.205 -3.977 1.00 0.19 C ATOM 55 C LEU A 4 -9.658 -14.308 -4.833 1.00 0.18 C ATOM 56 O LEU A 4 -9.514 -13.085 -4.831 1.00 0.18 O ATOM 57 CB LEU A 4 -7.762 -15.877 -4.861 1.00 0.22 C ATOM 58 CG LEU A 4 -6.476 -15.104 -4.958 1.00 0.25 C ATOM 59 CD1 LEU A 4 -5.696 -15.274 -3.675 1.00 0.64 C ATOM 60 CD2 LEU A 4 -5.687 -15.543 -6.178 1.00 0.52 C ATOM 0 H LEU A 4 -9.234 -17.160 -3.420 1.00 0.19 H new ATOM 0 HA LEU A 4 -8.283 -14.590 -3.226 1.00 0.19 H new ATOM 0 HB2 LEU A 4 -7.553 -16.874 -4.474 1.00 0.22 H new ATOM 0 HB3 LEU A 4 -8.181 -16.003 -5.859 1.00 0.22 H new ATOM 0 HG LEU A 4 -6.686 -14.042 -5.085 1.00 0.25 H new ATOM 0 HD11 LEU A 4 -4.762 -14.715 -3.740 1.00 0.64 H new ATOM 0 HD12 LEU A 4 -6.286 -14.899 -2.838 1.00 0.64 H new ATOM 0 HD13 LEU A 4 -5.477 -16.330 -3.520 1.00 0.64 H new ATOM 0 HD21 LEU A 4 -4.759 -14.975 -6.235 1.00 0.52 H new ATOM 0 HD22 LEU A 4 -5.458 -16.606 -6.100 1.00 0.52 H new ATOM 0 HD23 LEU A 4 -6.277 -15.364 -7.077 1.00 0.52 H new ATOM 72 N ILE A 5 -10.576 -14.932 -5.553 1.00 0.19 N ATOM 73 CA ILE A 5 -11.483 -14.211 -6.429 1.00 0.20 C ATOM 74 C ILE A 5 -12.405 -13.305 -5.630 1.00 0.19 C ATOM 75 O ILE A 5 -12.787 -12.233 -6.098 1.00 0.19 O ATOM 76 CB ILE A 5 -12.295 -15.186 -7.302 1.00 0.24 C ATOM 77 CG1 ILE A 5 -11.359 -15.846 -8.311 1.00 0.27 C ATOM 78 CG2 ILE A 5 -13.439 -14.469 -8.015 1.00 0.27 C ATOM 79 CD1 ILE A 5 -12.058 -16.746 -9.304 1.00 0.33 C ATOM 0 H ILE A 5 -10.712 -15.943 -5.547 1.00 0.19 H new ATOM 0 HA ILE A 5 -10.884 -13.584 -7.090 1.00 0.20 H new ATOM 0 HB ILE A 5 -12.740 -15.949 -6.663 1.00 0.24 H new ATOM 0 HG12 ILE A 5 -10.823 -15.069 -8.856 1.00 0.27 H new ATOM 0 HG13 ILE A 5 -10.613 -16.429 -7.771 1.00 0.27 H new ATOM 0 HG21 ILE A 5 -13.993 -15.184 -8.623 1.00 0.27 H new ATOM 0 HG22 ILE A 5 -14.107 -14.026 -7.277 1.00 0.27 H new ATOM 0 HG23 ILE A 5 -13.034 -13.685 -8.655 1.00 0.27 H new ATOM 0 HD11 ILE A 5 -11.324 -17.176 -9.985 1.00 0.33 H new ATOM 0 HD12 ILE A 5 -12.571 -17.547 -8.771 1.00 0.33 H new ATOM 0 HD13 ILE A 5 -12.784 -16.165 -9.873 1.00 0.33 H new ATOM 91 N GLN A 6 -12.756 -13.732 -4.425 1.00 0.19 N ATOM 92 CA GLN A 6 -13.602 -12.923 -3.566 1.00 0.20 C ATOM 93 C GLN A 6 -12.910 -11.600 -3.289 1.00 0.17 C ATOM 94 O GLN A 6 -13.486 -10.533 -3.481 1.00 0.17 O ATOM 95 CB GLN A 6 -13.897 -13.646 -2.258 1.00 0.23 C ATOM 96 CG GLN A 6 -15.250 -14.323 -2.246 1.00 0.28 C ATOM 97 CD GLN A 6 -16.377 -13.385 -2.642 1.00 0.39 C ATOM 98 OE1 GLN A 6 -16.674 -13.215 -3.823 1.00 0.60 O ATOM 99 NE2 GLN A 6 -17.020 -12.782 -1.657 1.00 0.47 N ATOM 0 H GLN A 6 -12.470 -14.626 -4.025 1.00 0.19 H new ATOM 0 HA GLN A 6 -14.551 -12.743 -4.071 1.00 0.20 H new ATOM 0 HB2 GLN A 6 -13.123 -14.392 -2.079 1.00 0.23 H new ATOM 0 HB3 GLN A 6 -13.847 -12.932 -1.436 1.00 0.23 H new ATOM 0 HG2 GLN A 6 -15.233 -15.173 -2.929 1.00 0.28 H new ATOM 0 HG3 GLN A 6 -15.445 -14.719 -1.249 1.00 0.28 H new ATOM 0 HE21 GLN A 6 -16.743 -12.949 -0.690 1.00 0.47 H new ATOM 0 HE22 GLN A 6 -17.793 -12.150 -1.864 1.00 0.47 H new ATOM 108 N GLY A 7 -11.651 -11.686 -2.873 1.00 0.16 N ATOM 109 CA GLY A 7 -10.879 -10.494 -2.595 1.00 0.15 C ATOM 110 C GLY A 7 -10.659 -9.673 -3.846 1.00 0.13 C ATOM 111 O GLY A 7 -10.645 -8.443 -3.797 1.00 0.13 O ATOM 0 H GLY A 7 -11.152 -12.563 -2.724 1.00 0.16 H new ATOM 0 HA2 GLY A 7 -11.395 -9.891 -1.848 1.00 0.15 H new ATOM 0 HA3 GLY A 7 -9.916 -10.774 -2.168 1.00 0.15 H new ATOM 115 N LYS A 8 -10.505 -10.360 -4.975 1.00 0.14 N ATOM 116 CA LYS A 8 -10.299 -9.705 -6.250 1.00 0.16 C ATOM 117 C LYS A 8 -11.536 -8.898 -6.610 1.00 0.16 C ATOM 118 O LYS A 8 -11.444 -7.716 -6.928 1.00 0.18 O ATOM 119 CB LYS A 8 -9.973 -10.754 -7.323 1.00 0.21 C ATOM 120 CG LYS A 8 -9.817 -10.191 -8.725 1.00 0.94 C ATOM 121 CD LYS A 8 -11.129 -10.254 -9.483 1.00 1.38 C ATOM 122 CE LYS A 8 -11.311 -11.588 -10.190 1.00 1.68 C ATOM 123 NZ LYS A 8 -12.536 -11.603 -11.032 1.00 2.00 N ATOM 0 H LYS A 8 -10.520 -11.379 -5.025 1.00 0.14 H new ATOM 0 HA LYS A 8 -9.455 -9.019 -6.187 1.00 0.16 H new ATOM 0 HB2 LYS A 8 -9.051 -11.265 -7.045 1.00 0.21 H new ATOM 0 HB3 LYS A 8 -10.764 -11.504 -7.332 1.00 0.21 H new ATOM 0 HG2 LYS A 8 -9.473 -9.158 -8.670 1.00 0.94 H new ATOM 0 HG3 LYS A 8 -9.054 -10.753 -9.264 1.00 0.94 H new ATOM 0 HD2 LYS A 8 -11.956 -10.094 -8.791 1.00 1.38 H new ATOM 0 HD3 LYS A 8 -11.165 -9.447 -10.215 1.00 1.38 H new ATOM 0 HE2 LYS A 8 -10.440 -11.792 -10.812 1.00 1.68 H new ATOM 0 HE3 LYS A 8 -11.368 -12.387 -9.450 1.00 1.68 H new ATOM 0 HZ1 LYS A 8 -12.626 -12.529 -11.498 1.00 2.00 H new ATOM 0 HZ2 LYS A 8 -13.370 -11.434 -10.434 1.00 2.00 H new ATOM 0 HZ3 LYS A 8 -12.470 -10.857 -11.754 1.00 2.00 H new ATOM 137 N LYS A 9 -12.688 -9.548 -6.551 1.00 0.17 N ATOM 138 CA LYS A 9 -13.953 -8.915 -6.836 1.00 0.21 C ATOM 139 C LYS A 9 -14.210 -7.755 -5.879 1.00 0.18 C ATOM 140 O LYS A 9 -14.589 -6.660 -6.295 1.00 0.18 O ATOM 141 CB LYS A 9 -15.042 -9.963 -6.679 1.00 0.27 C ATOM 142 CG LYS A 9 -16.252 -9.717 -7.534 1.00 0.45 C ATOM 143 CD LYS A 9 -17.317 -8.935 -6.782 1.00 0.91 C ATOM 144 CE LYS A 9 -18.641 -8.947 -7.521 1.00 1.53 C ATOM 145 NZ LYS A 9 -19.682 -8.166 -6.803 1.00 1.85 N ATOM 0 H LYS A 9 -12.765 -10.534 -6.302 1.00 0.17 H new ATOM 0 HA LYS A 9 -13.944 -8.513 -7.849 1.00 0.21 H new ATOM 0 HB2 LYS A 9 -14.629 -10.941 -6.924 1.00 0.27 H new ATOM 0 HB3 LYS A 9 -15.349 -10.000 -5.634 1.00 0.27 H new ATOM 0 HG2 LYS A 9 -15.960 -9.168 -8.429 1.00 0.45 H new ATOM 0 HG3 LYS A 9 -16.665 -10.670 -7.865 1.00 0.45 H new ATOM 0 HD2 LYS A 9 -17.450 -9.362 -5.788 1.00 0.91 H new ATOM 0 HD3 LYS A 9 -16.985 -7.906 -6.645 1.00 0.91 H new ATOM 0 HE2 LYS A 9 -18.503 -8.535 -8.521 1.00 1.53 H new ATOM 0 HE3 LYS A 9 -18.979 -9.976 -7.644 1.00 1.53 H new ATOM 0 HZ1 LYS A 9 -20.572 -8.198 -7.340 1.00 1.85 H new ATOM 0 HZ2 LYS A 9 -19.832 -8.574 -5.858 1.00 1.85 H new ATOM 0 HZ3 LYS A 9 -19.371 -7.178 -6.708 1.00 1.85 H new ATOM 159 N ILE A 10 -13.970 -8.010 -4.601 1.00 0.16 N ATOM 160 CA ILE A 10 -14.185 -7.025 -3.553 1.00 0.17 C ATOM 161 C ILE A 10 -13.322 -5.792 -3.759 1.00 0.14 C ATOM 162 O ILE A 10 -13.836 -4.679 -3.832 1.00 0.15 O ATOM 163 CB ILE A 10 -13.915 -7.646 -2.161 1.00 0.19 C ATOM 164 CG1 ILE A 10 -15.117 -8.492 -1.736 1.00 0.23 C ATOM 165 CG2 ILE A 10 -13.611 -6.575 -1.120 1.00 0.19 C ATOM 166 CD1 ILE A 10 -14.799 -9.522 -0.674 1.00 0.28 C ATOM 0 H ILE A 10 -13.621 -8.906 -4.262 1.00 0.16 H new ATOM 0 HA ILE A 10 -15.228 -6.712 -3.603 1.00 0.17 H new ATOM 0 HB ILE A 10 -13.034 -8.284 -2.232 1.00 0.19 H new ATOM 0 HG12 ILE A 10 -15.900 -7.831 -1.364 1.00 0.23 H new ATOM 0 HG13 ILE A 10 -15.519 -9.001 -2.612 1.00 0.23 H new ATOM 0 HG21 ILE A 10 -13.427 -7.047 -0.155 1.00 0.19 H new ATOM 0 HG22 ILE A 10 -12.728 -6.013 -1.423 1.00 0.19 H new ATOM 0 HG23 ILE A 10 -14.461 -5.898 -1.036 1.00 0.19 H new ATOM 0 HD11 ILE A 10 -15.702 -10.080 -0.427 1.00 0.28 H new ATOM 0 HD12 ILE A 10 -14.039 -10.208 -1.048 1.00 0.28 H new ATOM 0 HD13 ILE A 10 -14.427 -9.021 0.219 1.00 0.28 H new ATOM 178 N VAL A 11 -12.023 -5.990 -3.883 1.00 0.12 N ATOM 179 CA VAL A 11 -11.110 -4.875 -4.066 1.00 0.11 C ATOM 180 C VAL A 11 -11.336 -4.188 -5.404 1.00 0.12 C ATOM 181 O VAL A 11 -11.328 -2.956 -5.478 1.00 0.12 O ATOM 182 CB VAL A 11 -9.641 -5.310 -3.918 1.00 0.14 C ATOM 183 CG1 VAL A 11 -8.716 -4.439 -4.756 1.00 0.16 C ATOM 184 CG2 VAL A 11 -9.245 -5.259 -2.452 1.00 0.17 C ATOM 0 H VAL A 11 -11.577 -6.907 -3.861 1.00 0.12 H new ATOM 0 HA VAL A 11 -11.323 -4.156 -3.275 1.00 0.11 H new ATOM 0 HB VAL A 11 -9.542 -6.332 -4.284 1.00 0.14 H new ATOM 0 HG11 VAL A 11 -7.687 -4.774 -4.628 1.00 0.16 H new ATOM 0 HG12 VAL A 11 -8.995 -4.518 -5.807 1.00 0.16 H new ATOM 0 HG13 VAL A 11 -8.803 -3.401 -4.434 1.00 0.16 H new ATOM 0 HG21 VAL A 11 -8.205 -5.567 -2.345 1.00 0.17 H new ATOM 0 HG22 VAL A 11 -9.363 -4.242 -2.079 1.00 0.17 H new ATOM 0 HG23 VAL A 11 -9.883 -5.932 -1.879 1.00 0.17 H new ATOM 194 N ASN A 12 -11.544 -4.971 -6.458 1.00 0.13 N ATOM 195 CA ASN A 12 -11.789 -4.395 -7.776 1.00 0.17 C ATOM 196 C ASN A 12 -13.001 -3.485 -7.728 1.00 0.17 C ATOM 197 O ASN A 12 -13.002 -2.411 -8.323 1.00 0.19 O ATOM 198 CB ASN A 12 -11.991 -5.476 -8.836 1.00 0.22 C ATOM 199 CG ASN A 12 -10.792 -5.603 -9.753 1.00 0.52 C ATOM 200 OD1 ASN A 12 -10.102 -4.621 -10.032 1.00 1.14 O ATOM 201 ND2 ASN A 12 -10.531 -6.809 -10.224 1.00 0.83 N ATOM 0 H ASN A 12 -11.548 -5.991 -6.428 1.00 0.13 H new ATOM 0 HA ASN A 12 -10.908 -3.816 -8.054 1.00 0.17 H new ATOM 0 HB2 ASN A 12 -12.177 -6.433 -8.347 1.00 0.22 H new ATOM 0 HB3 ASN A 12 -12.877 -5.243 -9.427 1.00 0.22 H new ATOM 0 HD21 ASN A 12 -9.733 -6.953 -10.843 1.00 0.83 H new ATOM 0 HD22 ASN A 12 -11.127 -7.596 -9.969 1.00 0.83 H new ATOM 208 N HIS A 13 -14.022 -3.905 -6.990 1.00 0.17 N ATOM 209 CA HIS A 13 -15.231 -3.115 -6.852 1.00 0.19 C ATOM 210 C HIS A 13 -14.978 -1.929 -5.920 1.00 0.16 C ATOM 211 O HIS A 13 -15.415 -0.815 -6.191 1.00 0.17 O ATOM 212 CB HIS A 13 -16.378 -3.977 -6.319 1.00 0.24 C ATOM 213 CG HIS A 13 -17.667 -3.791 -7.063 1.00 0.40 C ATOM 214 ND1 HIS A 13 -17.958 -2.955 -8.090 1.00 1.00 N flip ATOM 215 CD2 HIS A 13 -18.794 -4.508 -6.739 1.00 1.16 C flip ATOM 216 CE1 HIS A 13 -19.278 -3.152 -8.403 1.00 0.93 C flip ATOM 217 NE2 HIS A 13 -19.738 -4.093 -7.567 1.00 1.07 N flip ATOM 0 H HIS A 13 -14.033 -4.788 -6.480 1.00 0.17 H new ATOM 0 HA HIS A 13 -15.515 -2.737 -7.834 1.00 0.19 H new ATOM 0 HB2 HIS A 13 -16.087 -5.026 -6.371 1.00 0.24 H new ATOM 0 HB3 HIS A 13 -16.539 -3.742 -5.267 1.00 0.24 H new ATOM 0 HD2 HIS A 13 -18.889 -5.257 -5.967 1.00 1.16 H new ATOM 0 HE1 HIS A 13 -19.839 -2.646 -9.175 1.00 0.93 H new ATOM 0 HE2 HIS A 13 -20.695 -4.445 -7.569 1.00 1.07 H new ATOM 225 N LEU A 14 -14.262 -2.191 -4.828 1.00 0.15 N ATOM 226 CA LEU A 14 -13.920 -1.175 -3.828 1.00 0.14 C ATOM 227 C LEU A 14 -13.231 0.038 -4.442 1.00 0.14 C ATOM 228 O LEU A 14 -13.668 1.167 -4.263 1.00 0.17 O ATOM 229 CB LEU A 14 -12.989 -1.792 -2.783 1.00 0.14 C ATOM 230 CG LEU A 14 -13.583 -1.995 -1.391 1.00 0.20 C ATOM 231 CD1 LEU A 14 -13.810 -0.662 -0.700 1.00 0.39 C ATOM 232 CD2 LEU A 14 -14.880 -2.782 -1.471 1.00 0.31 C ATOM 0 H LEU A 14 -13.900 -3.119 -4.609 1.00 0.15 H new ATOM 0 HA LEU A 14 -14.852 -0.836 -3.375 1.00 0.14 H new ATOM 0 HB2 LEU A 14 -12.648 -2.758 -3.155 1.00 0.14 H new ATOM 0 HB3 LEU A 14 -12.108 -1.157 -2.691 1.00 0.14 H new ATOM 0 HG LEU A 14 -12.869 -2.568 -0.799 1.00 0.20 H new ATOM 0 HD11 LEU A 14 -14.234 -0.833 0.290 1.00 0.39 H new ATOM 0 HD12 LEU A 14 -12.860 -0.136 -0.602 1.00 0.39 H new ATOM 0 HD13 LEU A 14 -14.499 -0.059 -1.291 1.00 0.39 H new ATOM 0 HD21 LEU A 14 -15.287 -2.916 -0.469 1.00 0.31 H new ATOM 0 HD22 LEU A 14 -15.598 -2.238 -2.085 1.00 0.31 H new ATOM 0 HD23 LEU A 14 -14.687 -3.758 -1.917 1.00 0.31 H new ATOM 244 N ARG A 15 -12.155 -0.209 -5.162 1.00 0.11 N ATOM 245 CA ARG A 15 -11.388 0.857 -5.795 1.00 0.13 C ATOM 246 C ARG A 15 -12.103 1.420 -7.003 1.00 0.13 C ATOM 247 O ARG A 15 -11.726 2.460 -7.518 1.00 0.14 O ATOM 248 CB ARG A 15 -10.030 0.331 -6.212 1.00 0.15 C ATOM 249 CG ARG A 15 -10.069 -0.763 -7.264 1.00 0.15 C ATOM 250 CD ARG A 15 -8.667 -1.295 -7.528 1.00 0.24 C ATOM 251 NE ARG A 15 -8.633 -2.330 -8.561 1.00 0.44 N ATOM 252 CZ ARG A 15 -7.547 -2.641 -9.274 1.00 0.49 C ATOM 253 NH1 ARG A 15 -6.423 -1.941 -9.134 1.00 0.57 N ATOM 254 NH2 ARG A 15 -7.591 -3.641 -10.143 1.00 0.86 N ATOM 0 H ARG A 15 -11.786 -1.145 -5.327 1.00 0.11 H new ATOM 0 HA ARG A 15 -11.272 1.660 -5.067 1.00 0.13 H new ATOM 0 HB2 ARG A 15 -9.435 1.161 -6.593 1.00 0.15 H new ATOM 0 HB3 ARG A 15 -9.517 -0.051 -5.329 1.00 0.15 H new ATOM 0 HG2 ARG A 15 -10.716 -1.574 -6.930 1.00 0.15 H new ATOM 0 HG3 ARG A 15 -10.497 -0.373 -8.188 1.00 0.15 H new ATOM 0 HD2 ARG A 15 -8.022 -0.469 -7.828 1.00 0.24 H new ATOM 0 HD3 ARG A 15 -8.258 -1.700 -6.602 1.00 0.24 H new ATOM 0 HE ARG A 15 -9.492 -2.847 -8.749 1.00 0.44 H new ATOM 0 HH11 ARG A 15 -6.387 -1.160 -8.478 1.00 0.57 H new ATOM 0 HH12 ARG A 15 -5.598 -2.185 -9.682 1.00 0.57 H new ATOM 0 HH21 ARG A 15 -8.453 -4.172 -10.267 1.00 0.86 H new ATOM 0 HH22 ARG A 15 -6.763 -3.880 -10.688 1.00 0.86 H new ATOM 268 N SER A 16 -13.106 0.719 -7.472 1.00 0.13 N ATOM 269 CA SER A 16 -13.860 1.184 -8.610 1.00 0.15 C ATOM 270 C SER A 16 -14.939 2.118 -8.123 1.00 0.14 C ATOM 271 O SER A 16 -15.215 3.138 -8.761 1.00 0.15 O ATOM 272 CB SER A 16 -14.437 0.013 -9.412 1.00 0.18 C ATOM 273 OG SER A 16 -15.663 -0.455 -8.865 1.00 0.22 O ATOM 0 H SER A 16 -13.418 -0.172 -7.085 1.00 0.13 H new ATOM 0 HA SER A 16 -13.202 1.724 -9.290 1.00 0.15 H new ATOM 0 HB2 SER A 16 -14.596 0.324 -10.444 1.00 0.18 H new ATOM 0 HB3 SER A 16 -13.715 -0.803 -9.433 1.00 0.18 H new ATOM 0 HG SER A 16 -15.562 -0.583 -7.899 1.00 0.22 H new ATOM 279 N ARG A 17 -15.556 1.794 -6.989 1.00 0.13 N ATOM 280 CA ARG A 17 -16.493 2.704 -6.451 1.00 0.14 C ATOM 281 C ARG A 17 -15.955 3.152 -5.111 1.00 0.13 C ATOM 282 O ARG A 17 -16.215 2.608 -4.038 1.00 0.13 O ATOM 283 CB ARG A 17 -17.858 2.017 -6.319 1.00 0.16 C ATOM 284 CG ARG A 17 -17.899 0.900 -5.287 1.00 0.15 C ATOM 285 CD ARG A 17 -18.639 -0.305 -5.800 1.00 0.18 C ATOM 286 NE ARG A 17 -18.757 -1.338 -4.771 1.00 0.23 N ATOM 287 CZ ARG A 17 -19.882 -2.009 -4.518 1.00 0.36 C ATOM 288 NH1 ARG A 17 -20.958 -1.808 -5.264 1.00 0.60 N ATOM 289 NH2 ARG A 17 -19.920 -2.899 -3.536 1.00 0.40 N ATOM 0 H ARG A 17 -15.414 0.934 -6.460 1.00 0.13 H new ATOM 0 HA ARG A 17 -16.634 3.571 -7.096 1.00 0.14 H new ATOM 0 HB2 ARG A 17 -18.605 2.766 -6.056 1.00 0.16 H new ATOM 0 HB3 ARG A 17 -18.142 1.610 -7.289 1.00 0.16 H new ATOM 0 HG2 ARG A 17 -16.882 0.615 -5.019 1.00 0.15 H new ATOM 0 HG3 ARG A 17 -18.379 1.262 -4.378 1.00 0.15 H new ATOM 0 HD2 ARG A 17 -19.633 -0.008 -6.135 1.00 0.18 H new ATOM 0 HD3 ARG A 17 -18.119 -0.711 -6.667 1.00 0.18 H new ATOM 0 HE ARG A 17 -17.931 -1.558 -4.214 1.00 0.23 H new ATOM 0 HH11 ARG A 17 -20.927 -1.139 -6.034 1.00 0.60 H new ATOM 0 HH12 ARG A 17 -21.817 -2.322 -5.069 1.00 0.60 H new ATOM 0 HH21 ARG A 17 -19.088 -3.072 -2.972 1.00 0.40 H new ATOM 0 HH22 ARG A 17 -20.781 -3.411 -3.345 1.00 0.40 H new ATOM 303 N LEU A 18 -15.194 4.189 -5.220 1.00 0.13 N ATOM 304 CA LEU A 18 -14.664 4.873 -4.061 1.00 0.13 C ATOM 305 C LEU A 18 -14.733 6.380 -4.280 1.00 0.14 C ATOM 306 O LEU A 18 -14.476 6.853 -5.390 1.00 0.16 O ATOM 307 CB LEU A 18 -13.234 4.410 -3.777 1.00 0.12 C ATOM 308 CG LEU A 18 -12.779 4.539 -2.321 1.00 0.17 C ATOM 309 CD1 LEU A 18 -13.864 4.059 -1.368 1.00 0.40 C ATOM 310 CD2 LEU A 18 -11.503 3.749 -2.104 1.00 0.61 C ATOM 0 H LEU A 18 -14.914 4.597 -6.112 1.00 0.13 H new ATOM 0 HA LEU A 18 -15.267 4.628 -3.186 1.00 0.13 H new ATOM 0 HB2 LEU A 18 -13.142 3.366 -4.078 1.00 0.12 H new ATOM 0 HB3 LEU A 18 -12.553 4.984 -4.405 1.00 0.12 H new ATOM 0 HG LEU A 18 -12.586 5.591 -2.113 1.00 0.17 H new ATOM 0 HD11 LEU A 18 -13.516 4.161 -0.340 1.00 0.40 H new ATOM 0 HD12 LEU A 18 -14.763 4.659 -1.508 1.00 0.40 H new ATOM 0 HD13 LEU A 18 -14.091 3.013 -1.572 1.00 0.40 H new ATOM 0 HD21 LEU A 18 -11.187 3.847 -1.065 1.00 0.61 H new ATOM 0 HD22 LEU A 18 -11.683 2.698 -2.331 1.00 0.61 H new ATOM 0 HD23 LEU A 18 -10.721 4.134 -2.759 1.00 0.61 H new ATOM 322 N ALA A 19 -15.090 7.139 -3.258 1.00 0.15 N ATOM 323 CA ALA A 19 -15.152 8.587 -3.395 1.00 0.16 C ATOM 324 C ALA A 19 -15.034 9.264 -2.047 1.00 0.17 C ATOM 325 O ALA A 19 -15.642 8.832 -1.073 1.00 0.16 O ATOM 326 CB ALA A 19 -16.447 9.009 -4.078 1.00 0.18 C ATOM 0 H ALA A 19 -15.339 6.784 -2.335 1.00 0.15 H new ATOM 0 HA ALA A 19 -14.311 8.899 -4.014 1.00 0.16 H new ATOM 0 HB1 ALA A 19 -16.473 10.095 -4.170 1.00 0.18 H new ATOM 0 HB2 ALA A 19 -16.499 8.559 -5.070 1.00 0.18 H new ATOM 0 HB3 ALA A 19 -17.297 8.675 -3.483 1.00 0.18 H new ATOM 332 N PHE A 20 -14.242 10.317 -1.979 1.00 0.17 N ATOM 333 CA PHE A 20 -14.090 11.048 -0.737 1.00 0.18 C ATOM 334 C PHE A 20 -14.392 12.514 -0.958 1.00 0.18 C ATOM 335 O PHE A 20 -14.092 13.074 -2.013 1.00 0.19 O ATOM 336 CB PHE A 20 -12.690 10.866 -0.123 1.00 0.19 C ATOM 337 CG PHE A 20 -11.562 11.543 -0.859 1.00 0.19 C ATOM 338 CD1 PHE A 20 -11.242 12.872 -0.608 1.00 1.04 C ATOM 339 CD2 PHE A 20 -10.800 10.839 -1.779 1.00 1.21 C ATOM 340 CE1 PHE A 20 -10.188 13.480 -1.263 1.00 0.99 C ATOM 341 CE2 PHE A 20 -9.749 11.447 -2.439 1.00 1.27 C ATOM 342 CZ PHE A 20 -9.442 12.768 -2.179 1.00 0.25 C ATOM 0 H PHE A 20 -13.699 10.682 -2.761 1.00 0.17 H new ATOM 0 HA PHE A 20 -14.805 10.639 -0.023 1.00 0.18 H new ATOM 0 HB2 PHE A 20 -12.710 11.242 0.900 1.00 0.19 H new ATOM 0 HB3 PHE A 20 -12.474 9.799 -0.066 1.00 0.19 H new ATOM 0 HD1 PHE A 20 -11.823 13.436 0.107 1.00 1.04 H new ATOM 0 HD2 PHE A 20 -11.030 9.804 -1.982 1.00 1.21 H new ATOM 0 HE1 PHE A 20 -9.948 14.513 -1.058 1.00 0.99 H new ATOM 0 HE2 PHE A 20 -9.168 10.889 -3.158 1.00 1.27 H new ATOM 0 HZ PHE A 20 -8.619 13.243 -2.692 1.00 0.25 H new ATOM 352 N GLU A 21 -15.014 13.121 0.023 1.00 0.18 N ATOM 353 CA GLU A 21 -15.349 14.520 -0.061 1.00 0.20 C ATOM 354 C GLU A 21 -14.318 15.309 0.720 1.00 0.20 C ATOM 355 O GLU A 21 -14.095 15.054 1.911 1.00 0.20 O ATOM 356 CB GLU A 21 -16.762 14.784 0.469 1.00 0.23 C ATOM 357 CG GLU A 21 -17.719 13.626 0.229 1.00 0.29 C ATOM 358 CD GLU A 21 -19.064 13.823 0.893 1.00 0.43 C ATOM 359 OE1 GLU A 21 -19.830 14.701 0.446 1.00 1.17 O ATOM 360 OE2 GLU A 21 -19.371 13.087 1.855 1.00 1.24 O ATOM 0 H GLU A 21 -15.299 12.666 0.891 1.00 0.18 H new ATOM 0 HA GLU A 21 -15.338 14.835 -1.104 1.00 0.20 H new ATOM 0 HB2 GLU A 21 -16.710 14.988 1.539 1.00 0.23 H new ATOM 0 HB3 GLU A 21 -17.160 15.680 -0.007 1.00 0.23 H new ATOM 0 HG2 GLU A 21 -17.865 13.499 -0.844 1.00 0.29 H new ATOM 0 HG3 GLU A 21 -17.268 12.706 0.601 1.00 0.29 H new ATOM 367 N TYR A 22 -13.651 16.213 0.026 1.00 0.20 N ATOM 368 CA TYR A 22 -12.637 17.054 0.627 1.00 0.22 C ATOM 369 C TYR A 22 -13.001 18.517 0.438 1.00 0.25 C ATOM 370 O TYR A 22 -13.109 18.995 -0.689 1.00 0.26 O ATOM 371 CB TYR A 22 -11.269 16.754 0.007 1.00 0.22 C ATOM 372 CG TYR A 22 -10.191 17.750 0.379 1.00 0.27 C ATOM 373 CD1 TYR A 22 -9.961 18.088 1.706 1.00 1.22 C ATOM 374 CD2 TYR A 22 -9.403 18.347 -0.598 1.00 1.24 C ATOM 375 CE1 TYR A 22 -8.981 18.996 2.049 1.00 1.27 C ATOM 376 CE2 TYR A 22 -8.418 19.257 -0.260 1.00 1.27 C ATOM 377 CZ TYR A 22 -8.212 19.575 1.065 1.00 0.50 C ATOM 378 OH TYR A 22 -7.232 20.479 1.410 1.00 0.63 O ATOM 0 H TYR A 22 -13.798 16.383 -0.969 1.00 0.20 H new ATOM 0 HA TYR A 22 -12.584 16.843 1.695 1.00 0.22 H new ATOM 0 HB2 TYR A 22 -10.952 15.758 0.317 1.00 0.22 H new ATOM 0 HB3 TYR A 22 -11.370 16.733 -1.078 1.00 0.22 H new ATOM 0 HD1 TYR A 22 -10.559 17.633 2.482 1.00 1.22 H new ATOM 0 HD2 TYR A 22 -9.562 18.097 -1.636 1.00 1.24 H new ATOM 0 HE1 TYR A 22 -8.818 19.252 3.086 1.00 1.27 H new ATOM 0 HE2 TYR A 22 -7.814 19.715 -1.029 1.00 1.27 H new ATOM 0 HH TYR A 22 -6.779 20.795 0.601 1.00 0.63 H new ATOM 388 N ASN A 23 -13.229 19.203 1.553 1.00 0.29 N ATOM 389 CA ASN A 23 -13.578 20.625 1.549 1.00 0.34 C ATOM 390 C ASN A 23 -14.880 20.890 0.805 1.00 0.32 C ATOM 391 O ASN A 23 -15.138 22.004 0.357 1.00 0.34 O ATOM 392 CB ASN A 23 -12.444 21.463 0.964 1.00 0.38 C ATOM 393 CG ASN A 23 -12.053 22.597 1.889 1.00 0.58 C ATOM 394 OD1 ASN A 23 -12.248 22.521 3.104 1.00 1.22 O ATOM 395 ND2 ASN A 23 -11.493 23.648 1.327 1.00 1.27 N ATOM 0 H ASN A 23 -13.178 18.792 2.485 1.00 0.29 H new ATOM 0 HA ASN A 23 -13.729 20.921 2.587 1.00 0.34 H new ATOM 0 HB2 ASN A 23 -11.578 20.827 0.781 1.00 0.38 H new ATOM 0 HB3 ASN A 23 -12.751 21.869 -0.000 1.00 0.38 H new ATOM 0 HD21 ASN A 23 -11.203 24.439 1.901 1.00 1.27 H new ATOM 0 HD22 ASN A 23 -11.350 23.671 0.317 1.00 1.27 H new ATOM 402 N GLY A 24 -15.699 19.858 0.677 1.00 0.30 N ATOM 403 CA GLY A 24 -16.969 20.001 0.003 1.00 0.30 C ATOM 404 C GLY A 24 -16.958 19.418 -1.390 1.00 0.28 C ATOM 405 O GLY A 24 -18.014 19.174 -1.974 1.00 0.33 O ATOM 0 H GLY A 24 -15.505 18.921 1.030 1.00 0.30 H new ATOM 0 HA2 GLY A 24 -17.745 19.511 0.591 1.00 0.30 H new ATOM 0 HA3 GLY A 24 -17.230 21.058 -0.052 1.00 0.30 H new ATOM 409 N GLN A 25 -15.768 19.174 -1.919 1.00 0.25 N ATOM 410 CA GLN A 25 -15.642 18.622 -3.261 1.00 0.25 C ATOM 411 C GLN A 25 -15.592 17.107 -3.221 1.00 0.22 C ATOM 412 O GLN A 25 -15.007 16.518 -2.315 1.00 0.22 O ATOM 413 CB GLN A 25 -14.393 19.148 -3.960 1.00 0.26 C ATOM 414 CG GLN A 25 -13.840 20.430 -3.358 1.00 0.31 C ATOM 415 CD GLN A 25 -12.902 21.158 -4.300 1.00 0.49 C ATOM 416 OE1 GLN A 25 -11.689 20.943 -4.280 1.00 1.04 O ATOM 417 NE2 GLN A 25 -13.455 22.020 -5.137 1.00 1.12 N ATOM 0 H GLN A 25 -14.882 19.348 -1.444 1.00 0.25 H new ATOM 0 HA GLN A 25 -16.521 18.938 -3.823 1.00 0.25 H new ATOM 0 HB2 GLN A 25 -13.620 18.380 -3.926 1.00 0.26 H new ATOM 0 HB3 GLN A 25 -14.624 19.322 -5.011 1.00 0.26 H new ATOM 0 HG2 GLN A 25 -14.667 21.089 -3.093 1.00 0.31 H new ATOM 0 HG3 GLN A 25 -13.311 20.195 -2.434 1.00 0.31 H new ATOM 0 HE21 GLN A 25 -14.464 22.170 -5.122 1.00 1.12 H new ATOM 0 HE22 GLN A 25 -12.873 22.535 -5.797 1.00 1.12 H new ATOM 426 N LEU A 26 -16.230 16.486 -4.195 1.00 0.22 N ATOM 427 CA LEU A 26 -16.260 15.033 -4.288 1.00 0.21 C ATOM 428 C LEU A 26 -15.152 14.513 -5.197 1.00 0.20 C ATOM 429 O LEU A 26 -15.191 14.696 -6.413 1.00 0.22 O ATOM 430 CB LEU A 26 -17.622 14.570 -4.802 1.00 0.25 C ATOM 431 CG LEU A 26 -18.622 14.173 -3.717 1.00 0.29 C ATOM 432 CD1 LEU A 26 -20.049 14.348 -4.215 1.00 0.41 C ATOM 433 CD2 LEU A 26 -18.378 12.736 -3.281 1.00 0.33 C ATOM 0 H LEU A 26 -16.738 16.965 -4.938 1.00 0.22 H new ATOM 0 HA LEU A 26 -16.094 14.627 -3.290 1.00 0.21 H new ATOM 0 HB2 LEU A 26 -18.058 15.369 -5.402 1.00 0.25 H new ATOM 0 HB3 LEU A 26 -17.472 13.719 -5.466 1.00 0.25 H new ATOM 0 HG LEU A 26 -18.481 14.826 -2.856 1.00 0.29 H new ATOM 0 HD11 LEU A 26 -20.747 14.060 -3.429 1.00 0.41 H new ATOM 0 HD12 LEU A 26 -20.215 15.391 -4.484 1.00 0.41 H new ATOM 0 HD13 LEU A 26 -20.209 13.718 -5.090 1.00 0.41 H new ATOM 0 HD21 LEU A 26 -19.096 12.464 -2.508 1.00 0.33 H new ATOM 0 HD22 LEU A 26 -18.496 12.071 -4.137 1.00 0.33 H new ATOM 0 HD23 LEU A 26 -17.366 12.642 -2.886 1.00 0.33 H new ATOM 445 N ILE A 27 -14.167 13.869 -4.598 1.00 0.19 N ATOM 446 CA ILE A 27 -13.048 13.315 -5.326 1.00 0.18 C ATOM 447 C ILE A 27 -13.140 11.792 -5.340 1.00 0.17 C ATOM 448 O ILE A 27 -13.056 11.142 -4.300 1.00 0.18 O ATOM 449 CB ILE A 27 -11.710 13.746 -4.699 1.00 0.18 C ATOM 450 CG1 ILE A 27 -11.599 15.274 -4.661 1.00 0.21 C ATOM 451 CG2 ILE A 27 -10.543 13.143 -5.466 1.00 0.19 C ATOM 452 CD1 ILE A 27 -12.087 15.896 -3.373 1.00 0.22 C ATOM 0 H ILE A 27 -14.124 13.717 -3.590 1.00 0.19 H new ATOM 0 HA ILE A 27 -13.087 13.694 -6.347 1.00 0.18 H new ATOM 0 HB ILE A 27 -11.676 13.376 -3.674 1.00 0.18 H new ATOM 0 HG12 ILE A 27 -10.558 15.556 -4.816 1.00 0.21 H new ATOM 0 HG13 ILE A 27 -12.169 15.690 -5.492 1.00 0.21 H new ATOM 0 HG21 ILE A 27 -9.605 13.458 -5.009 1.00 0.19 H new ATOM 0 HG22 ILE A 27 -10.612 12.056 -5.438 1.00 0.19 H new ATOM 0 HG23 ILE A 27 -10.574 13.482 -6.501 1.00 0.19 H new ATOM 0 HD11 ILE A 27 -11.975 16.979 -3.426 1.00 0.22 H new ATOM 0 HD12 ILE A 27 -13.138 15.647 -3.224 1.00 0.22 H new ATOM 0 HD13 ILE A 27 -11.501 15.511 -2.538 1.00 0.22 H new ATOM 464 N LYS A 28 -13.338 11.238 -6.518 1.00 0.17 N ATOM 465 CA LYS A 28 -13.459 9.797 -6.679 1.00 0.17 C ATOM 466 C LYS A 28 -12.097 9.128 -6.823 1.00 0.16 C ATOM 467 O LYS A 28 -11.143 9.715 -7.341 1.00 0.17 O ATOM 468 CB LYS A 28 -14.352 9.458 -7.881 1.00 0.19 C ATOM 469 CG LYS A 28 -14.131 10.351 -9.094 1.00 0.22 C ATOM 470 CD LYS A 28 -15.056 11.566 -9.084 1.00 0.28 C ATOM 471 CE LYS A 28 -16.503 11.178 -9.341 1.00 0.41 C ATOM 472 NZ LYS A 28 -17.337 12.358 -9.691 1.00 1.11 N ATOM 0 H LYS A 28 -13.420 11.766 -7.387 1.00 0.17 H new ATOM 0 HA LYS A 28 -13.925 9.407 -5.774 1.00 0.17 H new ATOM 0 HB2 LYS A 28 -14.176 8.422 -8.170 1.00 0.19 H new ATOM 0 HB3 LYS A 28 -15.396 9.531 -7.576 1.00 0.19 H new ATOM 0 HG2 LYS A 28 -13.094 10.685 -9.115 1.00 0.22 H new ATOM 0 HG3 LYS A 28 -14.299 9.775 -10.004 1.00 0.22 H new ATOM 0 HD2 LYS A 28 -14.981 12.072 -8.121 1.00 0.28 H new ATOM 0 HD3 LYS A 28 -14.730 12.277 -9.843 1.00 0.28 H new ATOM 0 HE2 LYS A 28 -16.546 10.450 -10.151 1.00 0.41 H new ATOM 0 HE3 LYS A 28 -16.912 10.694 -8.455 1.00 0.41 H new ATOM 0 HZ1 LYS A 28 -18.317 12.053 -9.859 1.00 1.11 H new ATOM 0 HZ2 LYS A 28 -17.317 13.042 -8.908 1.00 1.11 H new ATOM 0 HZ3 LYS A 28 -16.961 12.806 -10.551 1.00 1.11 H new ATOM 486 N ILE A 29 -12.029 7.894 -6.353 1.00 0.15 N ATOM 487 CA ILE A 29 -10.819 7.083 -6.402 1.00 0.14 C ATOM 488 C ILE A 29 -11.064 5.860 -7.267 1.00 0.13 C ATOM 489 O ILE A 29 -12.131 5.257 -7.188 1.00 0.14 O ATOM 490 CB ILE A 29 -10.341 6.613 -5.012 1.00 0.14 C ATOM 491 CG1 ILE A 29 -10.932 7.500 -3.908 1.00 0.14 C ATOM 492 CG2 ILE A 29 -8.820 6.643 -4.968 1.00 0.15 C ATOM 493 CD1 ILE A 29 -10.371 7.210 -2.529 1.00 0.16 C ATOM 0 H ILE A 29 -12.821 7.419 -5.921 1.00 0.15 H new ATOM 0 HA ILE A 29 -10.038 7.718 -6.820 1.00 0.14 H new ATOM 0 HB ILE A 29 -10.685 5.593 -4.840 1.00 0.14 H new ATOM 0 HG12 ILE A 29 -10.745 8.545 -4.154 1.00 0.14 H new ATOM 0 HG13 ILE A 29 -12.014 7.366 -3.886 1.00 0.14 H new ATOM 0 HG21 ILE A 29 -8.478 6.312 -3.988 1.00 0.15 H new ATOM 0 HG22 ILE A 29 -8.421 5.980 -5.735 1.00 0.15 H new ATOM 0 HG23 ILE A 29 -8.471 7.659 -5.150 1.00 0.15 H new ATOM 0 HD11 ILE A 29 -10.835 7.875 -1.800 1.00 0.16 H new ATOM 0 HD12 ILE A 29 -10.581 6.175 -2.261 1.00 0.16 H new ATOM 0 HD13 ILE A 29 -9.293 7.372 -2.533 1.00 0.16 H new ATOM 505 N LEU A 30 -10.097 5.503 -8.103 1.00 0.13 N ATOM 506 CA LEU A 30 -10.265 4.371 -8.988 1.00 0.13 C ATOM 507 C LEU A 30 -9.018 3.505 -9.001 1.00 0.13 C ATOM 508 O LEU A 30 -8.036 3.799 -8.323 1.00 0.13 O ATOM 509 CB LEU A 30 -10.606 4.833 -10.404 1.00 0.16 C ATOM 510 CG LEU A 30 -12.097 5.083 -10.667 1.00 0.22 C ATOM 511 CD1 LEU A 30 -12.428 6.564 -10.564 1.00 0.26 C ATOM 512 CD2 LEU A 30 -12.500 4.540 -12.031 1.00 0.31 C ATOM 0 H LEU A 30 -9.199 5.979 -8.182 1.00 0.13 H new ATOM 0 HA LEU A 30 -11.095 3.773 -8.612 1.00 0.13 H new ATOM 0 HB2 LEU A 30 -10.058 5.752 -10.611 1.00 0.16 H new ATOM 0 HB3 LEU A 30 -10.249 4.083 -11.110 1.00 0.16 H new ATOM 0 HG LEU A 30 -12.667 4.554 -9.903 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -13.491 6.713 -10.755 1.00 0.26 H new ATOM 0 HD12 LEU A 30 -12.185 6.922 -9.564 1.00 0.26 H new ATOM 0 HD13 LEU A 30 -11.846 7.119 -11.300 1.00 0.26 H new ATOM 0 HD21 LEU A 30 -13.561 4.727 -12.198 1.00 0.31 H new ATOM 0 HD22 LEU A 30 -11.917 5.036 -12.807 1.00 0.31 H new ATOM 0 HD23 LEU A 30 -12.311 3.467 -12.066 1.00 0.31 H new ATOM 524 N SER A 31 -9.072 2.459 -9.802 1.00 0.14 N ATOM 525 CA SER A 31 -7.991 1.496 -9.944 1.00 0.17 C ATOM 526 C SER A 31 -6.697 2.129 -10.456 1.00 0.18 C ATOM 527 O SER A 31 -5.622 1.534 -10.356 1.00 0.22 O ATOM 528 CB SER A 31 -8.463 0.402 -10.896 1.00 0.21 C ATOM 529 OG SER A 31 -9.490 0.899 -11.739 1.00 0.28 O ATOM 0 H SER A 31 -9.882 2.248 -10.384 1.00 0.14 H new ATOM 0 HA SER A 31 -7.756 1.087 -8.961 1.00 0.17 H new ATOM 0 HB2 SER A 31 -7.627 0.048 -11.499 1.00 0.21 H new ATOM 0 HB3 SER A 31 -8.830 -0.452 -10.327 1.00 0.21 H new ATOM 0 HG SER A 31 -9.785 0.190 -12.348 1.00 0.28 H new ATOM 535 N LYS A 32 -6.798 3.326 -11.013 1.00 0.19 N ATOM 536 CA LYS A 32 -5.623 4.022 -11.521 1.00 0.22 C ATOM 537 C LYS A 32 -4.868 4.699 -10.385 1.00 0.20 C ATOM 538 O LYS A 32 -3.656 4.903 -10.454 1.00 0.24 O ATOM 539 CB LYS A 32 -6.041 5.058 -12.558 1.00 0.27 C ATOM 540 CG LYS A 32 -6.096 4.507 -13.972 1.00 0.38 C ATOM 541 CD LYS A 32 -6.817 5.451 -14.919 1.00 0.58 C ATOM 542 CE LYS A 32 -6.650 5.015 -16.365 1.00 1.10 C ATOM 543 NZ LYS A 32 -5.221 4.992 -16.777 1.00 1.55 N ATOM 0 H LYS A 32 -7.675 3.834 -11.125 1.00 0.19 H new ATOM 0 HA LYS A 32 -4.963 3.292 -11.989 1.00 0.22 H new ATOM 0 HB2 LYS A 32 -7.021 5.453 -12.291 1.00 0.27 H new ATOM 0 HB3 LYS A 32 -5.342 5.894 -12.528 1.00 0.27 H new ATOM 0 HG2 LYS A 32 -5.083 4.333 -14.334 1.00 0.38 H new ATOM 0 HG3 LYS A 32 -6.602 3.542 -13.966 1.00 0.38 H new ATOM 0 HD2 LYS A 32 -7.877 5.484 -14.667 1.00 0.58 H new ATOM 0 HD3 LYS A 32 -6.428 6.462 -14.794 1.00 0.58 H new ATOM 0 HE2 LYS A 32 -7.082 4.023 -16.497 1.00 1.10 H new ATOM 0 HE3 LYS A 32 -7.204 5.693 -17.015 1.00 1.10 H new ATOM 0 HZ1 LYS A 32 -5.159 5.010 -17.815 1.00 1.55 H new ATOM 0 HZ2 LYS A 32 -4.734 5.824 -16.386 1.00 1.55 H new ATOM 0 HZ3 LYS A 32 -4.770 4.126 -16.418 1.00 1.55 H new ATOM 557 N ASN A 33 -5.595 5.022 -9.331 1.00 0.17 N ATOM 558 CA ASN A 33 -5.010 5.670 -8.165 1.00 0.17 C ATOM 559 C ASN A 33 -4.902 4.692 -7.004 1.00 0.15 C ATOM 560 O ASN A 33 -4.261 4.980 -5.990 1.00 0.15 O ATOM 561 CB ASN A 33 -5.833 6.880 -7.753 1.00 0.18 C ATOM 562 CG ASN A 33 -5.309 8.151 -8.389 1.00 0.28 C ATOM 563 OD1 ASN A 33 -4.125 8.273 -8.701 1.00 0.91 O ATOM 564 ND2 ASN A 33 -6.193 9.103 -8.587 1.00 1.19 N ATOM 0 H ASN A 33 -6.597 4.846 -9.256 1.00 0.17 H new ATOM 0 HA ASN A 33 -4.008 6.005 -8.433 1.00 0.17 H new ATOM 0 HB2 ASN A 33 -6.873 6.729 -8.042 1.00 0.18 H new ATOM 0 HB3 ASN A 33 -5.815 6.981 -6.668 1.00 0.18 H new ATOM 0 HD21 ASN A 33 -5.907 9.984 -9.014 1.00 1.19 H new ATOM 0 HD22 ASN A 33 -7.165 8.961 -8.314 1.00 1.19 H new ATOM 571 N ILE A 34 -5.511 3.525 -7.177 1.00 0.14 N ATOM 572 CA ILE A 34 -5.497 2.498 -6.146 1.00 0.13 C ATOM 573 C ILE A 34 -4.972 1.166 -6.690 1.00 0.14 C ATOM 574 O ILE A 34 -5.413 0.681 -7.735 1.00 0.16 O ATOM 575 CB ILE A 34 -6.899 2.306 -5.523 1.00 0.14 C ATOM 576 CG1 ILE A 34 -7.127 3.343 -4.428 1.00 0.15 C ATOM 577 CG2 ILE A 34 -7.054 0.907 -4.945 1.00 0.14 C ATOM 578 CD1 ILE A 34 -8.544 3.363 -3.903 1.00 0.18 C ATOM 0 H ILE A 34 -6.020 3.268 -8.022 1.00 0.14 H new ATOM 0 HA ILE A 34 -4.818 2.839 -5.364 1.00 0.13 H new ATOM 0 HB ILE A 34 -7.642 2.437 -6.310 1.00 0.14 H new ATOM 0 HG12 ILE A 34 -6.445 3.144 -3.602 1.00 0.15 H new ATOM 0 HG13 ILE A 34 -6.878 4.331 -4.816 1.00 0.15 H new ATOM 0 HG21 ILE A 34 -8.049 0.800 -4.513 1.00 0.14 H new ATOM 0 HG22 ILE A 34 -6.920 0.169 -5.736 1.00 0.14 H new ATOM 0 HG23 ILE A 34 -6.304 0.748 -4.170 1.00 0.14 H new ATOM 0 HD11 ILE A 34 -8.634 4.124 -3.127 1.00 0.18 H new ATOM 0 HD12 ILE A 34 -9.231 3.593 -4.718 1.00 0.18 H new ATOM 0 HD13 ILE A 34 -8.791 2.387 -3.485 1.00 0.18 H new ATOM 590 N VAL A 35 -4.050 0.570 -5.948 1.00 0.13 N ATOM 591 CA VAL A 35 -3.441 -0.700 -6.330 1.00 0.14 C ATOM 592 C VAL A 35 -3.757 -1.771 -5.289 1.00 0.13 C ATOM 593 O VAL A 35 -3.743 -1.497 -4.093 1.00 0.16 O ATOM 594 CB VAL A 35 -1.909 -0.569 -6.483 1.00 0.17 C ATOM 595 CG1 VAL A 35 -1.295 -1.869 -6.984 1.00 0.22 C ATOM 596 CG2 VAL A 35 -1.558 0.577 -7.418 1.00 0.24 C ATOM 0 H VAL A 35 -3.703 0.950 -5.067 1.00 0.13 H new ATOM 0 HA VAL A 35 -3.860 -0.989 -7.294 1.00 0.14 H new ATOM 0 HB VAL A 35 -1.493 -0.354 -5.499 1.00 0.17 H new ATOM 0 HG11 VAL A 35 -0.216 -1.748 -7.082 1.00 0.22 H new ATOM 0 HG12 VAL A 35 -1.507 -2.669 -6.274 1.00 0.22 H new ATOM 0 HG13 VAL A 35 -1.722 -2.123 -7.955 1.00 0.22 H new ATOM 0 HG21 VAL A 35 -0.475 0.651 -7.512 1.00 0.24 H new ATOM 0 HG22 VAL A 35 -1.995 0.393 -8.399 1.00 0.24 H new ATOM 0 HG23 VAL A 35 -1.952 1.510 -7.014 1.00 0.24 H new ATOM 606 N ALA A 36 -4.053 -2.981 -5.744 1.00 0.14 N ATOM 607 CA ALA A 36 -4.382 -4.085 -4.847 1.00 0.13 C ATOM 608 C ALA A 36 -3.120 -4.748 -4.307 1.00 0.13 C ATOM 609 O ALA A 36 -2.275 -5.207 -5.080 1.00 0.15 O ATOM 610 CB ALA A 36 -5.244 -5.102 -5.574 1.00 0.14 C ATOM 0 H ALA A 36 -4.072 -3.226 -6.734 1.00 0.14 H new ATOM 0 HA ALA A 36 -4.939 -3.685 -4.000 1.00 0.13 H new ATOM 0 HB1 ALA A 36 -5.486 -5.923 -4.899 1.00 0.14 H new ATOM 0 HB2 ALA A 36 -6.165 -4.625 -5.909 1.00 0.14 H new ATOM 0 HB3 ALA A 36 -4.701 -5.489 -6.436 1.00 0.14 H new ATOM 616 N VAL A 37 -2.979 -4.804 -2.985 1.00 0.13 N ATOM 617 CA VAL A 37 -1.792 -5.420 -2.398 1.00 0.13 C ATOM 618 C VAL A 37 -2.128 -6.458 -1.320 1.00 0.14 C ATOM 619 O VAL A 37 -3.299 -6.708 -1.001 1.00 0.14 O ATOM 620 CB VAL A 37 -0.815 -4.370 -1.822 1.00 0.16 C ATOM 621 CG1 VAL A 37 0.613 -4.692 -2.241 1.00 0.21 C ATOM 622 CG2 VAL A 37 -1.191 -2.963 -2.262 1.00 0.15 C ATOM 0 H VAL A 37 -3.654 -4.440 -2.313 1.00 0.13 H new ATOM 0 HA VAL A 37 -1.303 -5.939 -3.222 1.00 0.13 H new ATOM 0 HB VAL A 37 -0.883 -4.409 -0.735 1.00 0.16 H new ATOM 0 HG11 VAL A 37 1.291 -3.944 -1.828 1.00 0.21 H new ATOM 0 HG12 VAL A 37 0.889 -5.678 -1.866 1.00 0.21 H new ATOM 0 HG13 VAL A 37 0.683 -4.685 -3.329 1.00 0.21 H new ATOM 0 HG21 VAL A 37 -0.484 -2.249 -1.840 1.00 0.15 H new ATOM 0 HG22 VAL A 37 -1.162 -2.902 -3.350 1.00 0.15 H new ATOM 0 HG23 VAL A 37 -2.196 -2.729 -1.912 1.00 0.15 H new ATOM 632 N GLY A 38 -1.085 -7.099 -0.794 1.00 0.16 N ATOM 633 CA GLY A 38 -1.270 -8.091 0.240 1.00 0.18 C ATOM 634 C GLY A 38 -1.725 -9.419 -0.322 1.00 0.17 C ATOM 635 O GLY A 38 -1.024 -10.015 -1.138 1.00 0.18 O ATOM 0 H GLY A 38 -0.115 -6.945 -1.070 1.00 0.16 H new ATOM 0 HA2 GLY A 38 -0.334 -8.228 0.782 1.00 0.18 H new ATOM 0 HA3 GLY A 38 -2.005 -7.731 0.960 1.00 0.18 H new ATOM 639 N SER A 39 -2.900 -9.880 0.092 1.00 0.18 N ATOM 640 CA SER A 39 -3.421 -11.162 -0.388 1.00 0.20 C ATOM 641 C SER A 39 -3.753 -11.115 -1.870 1.00 0.19 C ATOM 642 O SER A 39 -3.747 -12.146 -2.545 1.00 0.22 O ATOM 643 CB SER A 39 -4.636 -11.581 0.429 1.00 0.24 C ATOM 644 OG SER A 39 -4.287 -11.731 1.793 1.00 0.88 O ATOM 0 H SER A 39 -3.507 -9.394 0.752 1.00 0.18 H new ATOM 0 HA SER A 39 -2.639 -11.909 -0.256 1.00 0.20 H new ATOM 0 HB2 SER A 39 -5.424 -10.835 0.329 1.00 0.24 H new ATOM 0 HB3 SER A 39 -5.035 -12.520 0.044 1.00 0.24 H new ATOM 0 HG SER A 39 -4.615 -10.960 2.301 1.00 0.88 H new ATOM 650 N LEU A 40 -4.021 -9.927 -2.380 1.00 0.18 N ATOM 651 CA LEU A 40 -4.315 -9.773 -3.792 1.00 0.19 C ATOM 652 C LEU A 40 -3.027 -9.873 -4.577 1.00 0.20 C ATOM 653 O LEU A 40 -3.000 -10.345 -5.708 1.00 0.24 O ATOM 654 CB LEU A 40 -4.979 -8.435 -4.053 1.00 0.19 C ATOM 655 CG LEU A 40 -6.432 -8.352 -3.611 1.00 0.20 C ATOM 656 CD1 LEU A 40 -6.591 -7.280 -2.551 1.00 0.21 C ATOM 657 CD2 LEU A 40 -7.339 -8.086 -4.803 1.00 0.22 C ATOM 0 H LEU A 40 -4.041 -9.061 -1.842 1.00 0.18 H new ATOM 0 HA LEU A 40 -5.000 -10.561 -4.105 1.00 0.19 H new ATOM 0 HB2 LEU A 40 -4.412 -7.657 -3.541 1.00 0.19 H new ATOM 0 HB3 LEU A 40 -4.925 -8.219 -5.120 1.00 0.19 H new ATOM 0 HG LEU A 40 -6.726 -9.308 -3.178 1.00 0.20 H new ATOM 0 HD11 LEU A 40 -7.634 -7.227 -2.240 1.00 0.21 H new ATOM 0 HD12 LEU A 40 -5.968 -7.524 -1.690 1.00 0.21 H new ATOM 0 HD13 LEU A 40 -6.285 -6.317 -2.959 1.00 0.21 H new ATOM 0 HD21 LEU A 40 -8.374 -8.030 -4.467 1.00 0.22 H new ATOM 0 HD22 LEU A 40 -7.058 -7.143 -5.271 1.00 0.22 H new ATOM 0 HD23 LEU A 40 -7.236 -8.895 -5.526 1.00 0.22 H new ATOM 669 N ARG A 41 -1.958 -9.398 -3.955 1.00 0.19 N ATOM 670 CA ARG A 41 -0.641 -9.444 -4.547 1.00 0.21 C ATOM 671 C ARG A 41 -0.066 -10.856 -4.442 1.00 0.20 C ATOM 672 O ARG A 41 0.651 -11.306 -5.337 1.00 0.23 O ATOM 673 CB ARG A 41 0.283 -8.456 -3.833 1.00 0.24 C ATOM 674 CG ARG A 41 1.364 -7.862 -4.720 1.00 0.67 C ATOM 675 CD ARG A 41 0.829 -6.721 -5.570 1.00 0.93 C ATOM 676 NE ARG A 41 0.853 -7.044 -6.993 1.00 1.26 N ATOM 677 CZ ARG A 41 -0.209 -6.970 -7.796 1.00 1.76 C ATOM 678 NH1 ARG A 41 -1.374 -6.523 -7.340 1.00 2.40 N ATOM 679 NH2 ARG A 41 -0.101 -7.336 -9.063 1.00 2.26 N ATOM 0 H ARG A 41 -1.985 -8.972 -3.029 1.00 0.19 H new ATOM 0 HA ARG A 41 -0.717 -9.170 -5.599 1.00 0.21 H new ATOM 0 HB2 ARG A 41 -0.319 -7.646 -3.421 1.00 0.24 H new ATOM 0 HB3 ARG A 41 0.756 -8.962 -2.991 1.00 0.24 H new ATOM 0 HG2 ARG A 41 2.185 -7.501 -4.101 1.00 0.67 H new ATOM 0 HG3 ARG A 41 1.771 -8.639 -5.368 1.00 0.67 H new ATOM 0 HD2 ARG A 41 -0.193 -6.491 -5.267 1.00 0.93 H new ATOM 0 HD3 ARG A 41 1.424 -5.825 -5.391 1.00 0.93 H new ATOM 0 HE ARG A 41 1.739 -7.346 -7.399 1.00 1.26 H new ATOM 0 HH11 ARG A 41 -1.463 -6.232 -6.366 1.00 2.40 H new ATOM 0 HH12 ARG A 41 -2.180 -6.471 -7.963 1.00 2.40 H new ATOM 0 HH21 ARG A 41 0.792 -7.673 -9.422 1.00 2.26 H new ATOM 0 HH22 ARG A 41 -0.911 -7.281 -9.681 1.00 2.26 H new ATOM 693 N ARG A 42 -0.368 -11.548 -3.334 1.00 0.19 N ATOM 694 CA ARG A 42 0.145 -12.901 -3.132 1.00 0.20 C ATOM 695 C ARG A 42 -0.625 -13.947 -3.916 1.00 0.22 C ATOM 696 O ARG A 42 -0.027 -14.932 -4.337 1.00 0.26 O ATOM 697 CB ARG A 42 0.040 -13.286 -1.661 1.00 0.22 C ATOM 698 CG ARG A 42 1.000 -12.564 -0.750 1.00 0.26 C ATOM 699 CD ARG A 42 0.621 -12.776 0.703 1.00 0.42 C ATOM 700 NE ARG A 42 0.331 -14.188 1.015 1.00 1.18 N ATOM 701 CZ ARG A 42 1.265 -15.127 1.216 1.00 1.76 C ATOM 702 NH1 ARG A 42 2.550 -14.810 1.145 1.00 1.94 N ATOM 703 NH2 ARG A 42 0.915 -16.386 1.478 1.00 2.64 N ATOM 0 H ARG A 42 -0.956 -11.196 -2.578 1.00 0.19 H new ATOM 0 HA ARG A 42 1.179 -12.883 -3.478 1.00 0.20 H new ATOM 0 HB2 ARG A 42 -0.977 -13.093 -1.321 1.00 0.22 H new ATOM 0 HB3 ARG A 42 0.209 -14.359 -1.567 1.00 0.22 H new ATOM 0 HG2 ARG A 42 2.014 -12.924 -0.923 1.00 0.26 H new ATOM 0 HG3 ARG A 42 0.997 -11.499 -0.980 1.00 0.26 H new ATOM 0 HD2 ARG A 42 1.433 -12.427 1.341 1.00 0.42 H new ATOM 0 HD3 ARG A 42 -0.253 -12.169 0.939 1.00 0.42 H new ATOM 0 HE ARG A 42 -0.647 -14.469 1.082 1.00 1.18 H new ATOM 0 HH11 ARG A 42 2.828 -13.851 0.937 1.00 1.94 H new ATOM 0 HH12 ARG A 42 3.261 -15.525 1.298 1.00 1.94 H new ATOM 0 HH21 ARG A 42 -0.071 -16.642 1.527 1.00 2.64 H new ATOM 0 HH22 ARG A 42 1.633 -17.094 1.630 1.00 2.64 H new ATOM 717 N GLU A 43 -1.917 -13.709 -4.166 1.00 0.24 N ATOM 718 CA GLU A 43 -2.734 -14.657 -4.918 1.00 0.27 C ATOM 719 C GLU A 43 -2.490 -16.083 -4.431 1.00 0.29 C ATOM 720 O GLU A 43 -1.827 -16.863 -5.122 1.00 0.49 O ATOM 721 CB GLU A 43 -2.406 -14.585 -6.414 1.00 0.44 C ATOM 722 CG GLU A 43 -2.554 -13.210 -7.037 1.00 0.64 C ATOM 723 CD GLU A 43 -1.903 -13.141 -8.402 1.00 0.74 C ATOM 724 OE1 GLU A 43 -0.663 -13.011 -8.463 1.00 1.44 O ATOM 725 OE2 GLU A 43 -2.625 -13.229 -9.421 1.00 1.41 O ATOM 0 H GLU A 43 -2.414 -12.873 -3.859 1.00 0.24 H new ATOM 0 HA GLU A 43 -3.779 -14.391 -4.759 1.00 0.27 H new ATOM 0 HB2 GLU A 43 -1.382 -14.927 -6.563 1.00 0.44 H new ATOM 0 HB3 GLU A 43 -3.055 -15.281 -6.947 1.00 0.44 H new ATOM 0 HG2 GLU A 43 -3.612 -12.962 -7.125 1.00 0.64 H new ATOM 0 HG3 GLU A 43 -2.106 -12.463 -6.382 1.00 0.64 H new ATOM 732 N GLU A 44 -3.004 -16.462 -3.264 1.00 0.45 N ATOM 733 CA GLU A 44 -2.711 -17.816 -2.822 1.00 0.85 C ATOM 734 C GLU A 44 -3.881 -18.774 -2.991 1.00 1.04 C ATOM 735 O GLU A 44 -4.163 -19.222 -4.100 1.00 1.93 O ATOM 736 CB GLU A 44 -2.308 -17.701 -1.343 1.00 1.03 C ATOM 737 CG GLU A 44 -1.692 -18.948 -0.737 1.00 1.32 C ATOM 738 CD GLU A 44 -1.759 -18.929 0.778 1.00 1.61 C ATOM 739 OE1 GLU A 44 -1.226 -17.979 1.395 1.00 2.31 O ATOM 740 OE2 GLU A 44 -2.354 -19.859 1.359 1.00 2.18 O ATOM 0 H GLU A 44 -3.585 -15.895 -2.647 1.00 0.45 H new ATOM 0 HA GLU A 44 -1.916 -18.239 -3.436 1.00 0.85 H new ATOM 0 HB2 GLU A 44 -1.599 -16.879 -1.240 1.00 1.03 H new ATOM 0 HB3 GLU A 44 -3.191 -17.434 -0.763 1.00 1.03 H new ATOM 0 HG2 GLU A 44 -2.211 -19.830 -1.113 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -0.652 -19.031 -1.054 1.00 1.32 H new ATOM 747 N LYS A 45 -4.552 -19.068 -1.920 1.00 0.66 N ATOM 748 CA LYS A 45 -5.735 -19.911 -1.980 1.00 0.75 C ATOM 749 C LYS A 45 -6.950 -19.222 -1.419 1.00 0.38 C ATOM 750 O LYS A 45 -8.031 -19.212 -2.009 1.00 0.43 O ATOM 751 CB LYS A 45 -5.507 -21.250 -1.273 1.00 1.05 C ATOM 752 CG LYS A 45 -6.531 -22.318 -1.644 1.00 1.01 C ATOM 753 CD LYS A 45 -6.688 -22.445 -3.153 1.00 1.40 C ATOM 754 CE LYS A 45 -7.376 -23.743 -3.549 1.00 1.53 C ATOM 755 NZ LYS A 45 -6.492 -24.922 -3.364 1.00 2.08 N ATOM 0 H LYS A 45 -4.310 -18.742 -0.984 1.00 0.66 H new ATOM 0 HA LYS A 45 -5.922 -20.108 -3.036 1.00 0.75 H new ATOM 0 HB2 LYS A 45 -4.509 -21.615 -1.517 1.00 1.05 H new ATOM 0 HB3 LYS A 45 -5.534 -21.091 -0.195 1.00 1.05 H new ATOM 0 HG2 LYS A 45 -6.224 -23.277 -1.228 1.00 1.01 H new ATOM 0 HG3 LYS A 45 -7.494 -22.070 -1.197 1.00 1.01 H new ATOM 0 HD2 LYS A 45 -7.264 -21.600 -3.530 1.00 1.40 H new ATOM 0 HD3 LYS A 45 -5.706 -22.397 -3.625 1.00 1.40 H new ATOM 0 HE2 LYS A 45 -8.280 -23.871 -2.953 1.00 1.53 H new ATOM 0 HE3 LYS A 45 -7.688 -23.684 -4.592 1.00 1.53 H new ATOM 0 HZ1 LYS A 45 -6.899 -25.742 -3.858 1.00 2.08 H new ATOM 0 HZ2 LYS A 45 -5.551 -24.715 -3.755 1.00 2.08 H new ATOM 0 HZ3 LYS A 45 -6.407 -25.136 -2.350 1.00 2.08 H new ATOM 769 N MET A 46 -6.727 -18.633 -0.259 1.00 0.29 N ATOM 770 CA MET A 46 -7.791 -18.016 0.506 1.00 0.43 C ATOM 771 C MET A 46 -7.500 -16.575 0.846 1.00 0.45 C ATOM 772 O MET A 46 -6.350 -16.168 1.012 1.00 0.63 O ATOM 773 CB MET A 46 -8.017 -18.803 1.805 1.00 0.62 C ATOM 774 CG MET A 46 -9.057 -19.904 1.693 1.00 0.68 C ATOM 775 SD MET A 46 -10.589 -19.499 2.561 1.00 1.00 S ATOM 776 CE MET A 46 -11.745 -20.592 1.734 1.00 1.09 C ATOM 0 H MET A 46 -5.807 -18.570 0.177 1.00 0.29 H new ATOM 0 HA MET A 46 -8.685 -18.035 -0.117 1.00 0.43 H new ATOM 0 HB2 MET A 46 -7.071 -19.243 2.119 1.00 0.62 H new ATOM 0 HB3 MET A 46 -8.322 -18.109 2.589 1.00 0.62 H new ATOM 0 HG2 MET A 46 -9.276 -20.086 0.641 1.00 0.68 H new ATOM 0 HG3 MET A 46 -8.647 -20.829 2.098 1.00 0.68 H new ATOM 0 HE1 MET A 46 -12.740 -20.459 2.160 1.00 1.09 H new ATOM 0 HE2 MET A 46 -11.771 -20.356 0.670 1.00 1.09 H new ATOM 0 HE3 MET A 46 -11.428 -21.626 1.869 1.00 1.09 H new ATOM 786 N LEU A 47 -8.566 -15.823 0.939 1.00 0.36 N ATOM 787 CA LEU A 47 -8.524 -14.431 1.282 1.00 0.36 C ATOM 788 C LEU A 47 -8.856 -14.228 2.756 1.00 0.36 C ATOM 789 O LEU A 47 -9.968 -14.531 3.201 1.00 0.43 O ATOM 790 CB LEU A 47 -9.524 -13.711 0.394 1.00 0.34 C ATOM 791 CG LEU A 47 -8.893 -12.842 -0.685 1.00 0.33 C ATOM 792 CD1 LEU A 47 -8.507 -11.503 -0.101 1.00 0.32 C ATOM 793 CD2 LEU A 47 -7.667 -13.515 -1.281 1.00 0.34 C ATOM 0 H LEU A 47 -9.509 -16.174 0.774 1.00 0.36 H new ATOM 0 HA LEU A 47 -7.523 -14.029 1.124 1.00 0.36 H new ATOM 0 HB2 LEU A 47 -10.168 -14.451 -0.082 1.00 0.34 H new ATOM 0 HB3 LEU A 47 -10.163 -13.087 1.019 1.00 0.34 H new ATOM 0 HG LEU A 47 -9.625 -12.698 -1.480 1.00 0.33 H new ATOM 0 HD11 LEU A 47 -8.056 -10.884 -0.877 1.00 0.32 H new ATOM 0 HD12 LEU A 47 -9.396 -11.006 0.288 1.00 0.32 H new ATOM 0 HD13 LEU A 47 -7.791 -11.651 0.707 1.00 0.32 H new ATOM 0 HD21 LEU A 47 -7.236 -12.872 -2.049 1.00 0.34 H new ATOM 0 HD22 LEU A 47 -6.930 -13.688 -0.497 1.00 0.34 H new ATOM 0 HD23 LEU A 47 -7.955 -14.468 -1.725 1.00 0.34 H new ATOM 805 N ASN A 48 -7.892 -13.719 3.514 1.00 0.32 N ATOM 806 CA ASN A 48 -8.072 -13.481 4.937 1.00 0.36 C ATOM 807 C ASN A 48 -8.169 -11.999 5.175 1.00 0.30 C ATOM 808 O ASN A 48 -9.085 -11.508 5.832 1.00 0.34 O ATOM 809 CB ASN A 48 -6.877 -14.017 5.709 1.00 0.46 C ATOM 810 CG ASN A 48 -7.205 -14.349 7.153 1.00 0.73 C ATOM 811 OD1 ASN A 48 -7.656 -15.451 7.463 1.00 1.01 O ATOM 812 ND2 ASN A 48 -6.966 -13.401 8.045 1.00 1.26 N ATOM 0 H ASN A 48 -6.970 -13.462 3.161 1.00 0.32 H new ATOM 0 HA ASN A 48 -8.979 -13.984 5.272 1.00 0.36 H new ATOM 0 HB2 ASN A 48 -6.502 -14.912 5.212 1.00 0.46 H new ATOM 0 HB3 ASN A 48 -6.075 -13.279 5.685 1.00 0.46 H new ATOM 0 HD21 ASN A 48 -7.156 -13.570 9.033 1.00 1.26 H new ATOM 0 HD22 ASN A 48 -6.592 -12.501 7.745 1.00 1.26 H new ATOM 819 N ASP A 49 -7.202 -11.303 4.612 1.00 0.25 N ATOM 820 CA ASP A 49 -7.127 -9.862 4.720 1.00 0.25 C ATOM 821 C ASP A 49 -6.753 -9.284 3.374 1.00 0.21 C ATOM 822 O ASP A 49 -5.993 -9.892 2.621 1.00 0.24 O ATOM 823 CB ASP A 49 -6.094 -9.412 5.764 1.00 0.32 C ATOM 824 CG ASP A 49 -6.123 -10.225 7.041 1.00 0.56 C ATOM 825 OD1 ASP A 49 -6.882 -9.870 7.963 1.00 1.23 O ATOM 826 OD2 ASP A 49 -5.364 -11.217 7.135 1.00 1.41 O ATOM 0 H ASP A 49 -6.447 -11.721 4.068 1.00 0.25 H new ATOM 0 HA ASP A 49 -8.104 -9.501 5.041 1.00 0.25 H new ATOM 0 HB2 ASP A 49 -5.098 -9.475 5.326 1.00 0.32 H new ATOM 0 HB3 ASP A 49 -6.270 -8.364 6.007 1.00 0.32 H new ATOM 831 N VAL A 50 -7.284 -8.123 3.064 1.00 0.17 N ATOM 832 CA VAL A 50 -6.980 -7.477 1.791 1.00 0.16 C ATOM 833 C VAL A 50 -6.230 -6.181 2.009 1.00 0.16 C ATOM 834 O VAL A 50 -6.580 -5.400 2.892 1.00 0.20 O ATOM 835 CB VAL A 50 -8.256 -7.162 0.973 1.00 0.18 C ATOM 836 CG1 VAL A 50 -8.625 -8.319 0.073 1.00 0.21 C ATOM 837 CG2 VAL A 50 -9.420 -6.812 1.887 1.00 0.21 C ATOM 0 H VAL A 50 -7.924 -7.604 3.665 1.00 0.17 H new ATOM 0 HA VAL A 50 -6.366 -8.183 1.233 1.00 0.16 H new ATOM 0 HB VAL A 50 -8.039 -6.296 0.347 1.00 0.18 H new ATOM 0 HG11 VAL A 50 -9.525 -8.070 -0.489 1.00 0.21 H new ATOM 0 HG12 VAL A 50 -7.807 -8.516 -0.620 1.00 0.21 H new ATOM 0 HG13 VAL A 50 -8.810 -9.206 0.678 1.00 0.21 H new ATOM 0 HG21 VAL A 50 -10.303 -6.595 1.285 1.00 0.21 H new ATOM 0 HG22 VAL A 50 -9.629 -7.653 2.548 1.00 0.21 H new ATOM 0 HG23 VAL A 50 -9.164 -5.936 2.483 1.00 0.21 H new ATOM 847 N ASP A 51 -5.177 -5.959 1.238 1.00 0.14 N ATOM 848 CA ASP A 51 -4.427 -4.726 1.354 1.00 0.14 C ATOM 849 C ASP A 51 -4.583 -3.911 0.077 1.00 0.13 C ATOM 850 O ASP A 51 -4.824 -4.458 -1.000 1.00 0.13 O ATOM 851 CB ASP A 51 -2.951 -5.011 1.641 1.00 0.15 C ATOM 852 CG ASP A 51 -2.741 -5.981 2.799 1.00 0.21 C ATOM 853 OD1 ASP A 51 -2.738 -7.214 2.571 1.00 1.13 O ATOM 854 OD2 ASP A 51 -2.557 -5.520 3.943 1.00 1.10 O ATOM 0 H ASP A 51 -4.828 -6.610 0.534 1.00 0.14 H new ATOM 0 HA ASP A 51 -4.821 -4.150 2.191 1.00 0.14 H new ATOM 0 HB2 ASP A 51 -2.485 -5.420 0.744 1.00 0.15 H new ATOM 0 HB3 ASP A 51 -2.443 -4.073 1.865 1.00 0.15 H new ATOM 859 N LEU A 52 -4.472 -2.605 0.200 1.00 0.13 N ATOM 860 CA LEU A 52 -4.606 -1.711 -0.937 1.00 0.13 C ATOM 861 C LEU A 52 -3.623 -0.555 -0.824 1.00 0.13 C ATOM 862 O LEU A 52 -3.245 -0.158 0.272 1.00 0.15 O ATOM 863 CB LEU A 52 -6.031 -1.147 -1.021 1.00 0.13 C ATOM 864 CG LEU A 52 -7.055 -1.996 -1.776 1.00 0.15 C ATOM 865 CD1 LEU A 52 -8.438 -1.375 -1.671 1.00 0.15 C ATOM 866 CD2 LEU A 52 -6.663 -2.134 -3.232 1.00 0.23 C ATOM 0 H LEU A 52 -4.287 -2.132 1.085 1.00 0.13 H new ATOM 0 HA LEU A 52 -4.392 -2.286 -1.838 1.00 0.13 H new ATOM 0 HB2 LEU A 52 -6.397 -0.992 -0.006 1.00 0.13 H new ATOM 0 HB3 LEU A 52 -5.983 -0.167 -1.496 1.00 0.13 H new ATOM 0 HG LEU A 52 -7.076 -2.987 -1.323 1.00 0.15 H new ATOM 0 HD11 LEU A 52 -9.155 -1.991 -2.213 1.00 0.15 H new ATOM 0 HD12 LEU A 52 -8.731 -1.314 -0.623 1.00 0.15 H new ATOM 0 HD13 LEU A 52 -8.421 -0.374 -2.101 1.00 0.15 H new ATOM 0 HD21 LEU A 52 -7.404 -2.741 -3.752 1.00 0.23 H new ATOM 0 HD22 LEU A 52 -6.616 -1.147 -3.691 1.00 0.23 H new ATOM 0 HD23 LEU A 52 -5.687 -2.614 -3.302 1.00 0.23 H new ATOM 878 N LEU A 53 -3.262 0.015 -1.955 1.00 0.13 N ATOM 879 CA LEU A 53 -2.309 1.111 -1.977 1.00 0.14 C ATOM 880 C LEU A 53 -2.800 2.267 -2.843 1.00 0.12 C ATOM 881 O LEU A 53 -2.880 2.146 -4.064 1.00 0.15 O ATOM 882 CB LEU A 53 -0.949 0.598 -2.484 1.00 0.18 C ATOM 883 CG LEU A 53 0.198 1.620 -2.556 1.00 0.24 C ATOM 884 CD1 LEU A 53 0.280 2.256 -3.934 1.00 0.63 C ATOM 885 CD2 LEU A 53 0.053 2.690 -1.485 1.00 0.75 C ATOM 0 H LEU A 53 -3.613 -0.261 -2.872 1.00 0.13 H new ATOM 0 HA LEU A 53 -2.200 1.491 -0.961 1.00 0.14 H new ATOM 0 HB2 LEU A 53 -0.633 -0.221 -1.838 1.00 0.18 H new ATOM 0 HB3 LEU A 53 -1.094 0.180 -3.480 1.00 0.18 H new ATOM 0 HG LEU A 53 1.127 1.080 -2.372 1.00 0.24 H new ATOM 0 HD11 LEU A 53 1.100 2.974 -3.955 1.00 0.63 H new ATOM 0 HD12 LEU A 53 0.456 1.483 -4.682 1.00 0.63 H new ATOM 0 HD13 LEU A 53 -0.657 2.768 -4.155 1.00 0.63 H new ATOM 0 HD21 LEU A 53 0.879 3.397 -1.563 1.00 0.75 H new ATOM 0 HD22 LEU A 53 -0.891 3.218 -1.623 1.00 0.75 H new ATOM 0 HD23 LEU A 53 0.066 2.223 -0.500 1.00 0.75 H new ATOM 897 N ILE A 54 -3.172 3.364 -2.200 1.00 0.11 N ATOM 898 CA ILE A 54 -3.601 4.551 -2.919 1.00 0.11 C ATOM 899 C ILE A 54 -2.451 5.559 -2.966 1.00 0.12 C ATOM 900 O ILE A 54 -1.871 5.906 -1.935 1.00 0.14 O ATOM 901 CB ILE A 54 -4.866 5.193 -2.304 1.00 0.13 C ATOM 902 CG1 ILE A 54 -5.203 6.513 -3.012 1.00 0.70 C ATOM 903 CG2 ILE A 54 -4.694 5.410 -0.815 1.00 0.62 C ATOM 904 CD1 ILE A 54 -6.366 7.266 -2.396 1.00 0.75 C ATOM 0 H ILE A 54 -3.185 3.455 -1.184 1.00 0.11 H new ATOM 0 HA ILE A 54 -3.870 4.249 -3.931 1.00 0.11 H new ATOM 0 HB ILE A 54 -5.699 4.505 -2.449 1.00 0.13 H new ATOM 0 HG12 ILE A 54 -4.322 7.154 -3.001 1.00 0.70 H new ATOM 0 HG13 ILE A 54 -5.432 6.304 -4.057 1.00 0.70 H new ATOM 0 HG21 ILE A 54 -5.598 5.863 -0.407 1.00 0.62 H new ATOM 0 HG22 ILE A 54 -4.515 4.452 -0.326 1.00 0.62 H new ATOM 0 HG23 ILE A 54 -3.846 6.071 -0.639 1.00 0.62 H new ATOM 0 HD11 ILE A 54 -6.540 8.186 -2.954 1.00 0.75 H new ATOM 0 HD12 ILE A 54 -7.261 6.645 -2.432 1.00 0.75 H new ATOM 0 HD13 ILE A 54 -6.134 7.509 -1.359 1.00 0.75 H new ATOM 916 N ILE A 55 -2.105 6.005 -4.157 1.00 0.12 N ATOM 917 CA ILE A 55 -1.025 6.969 -4.313 1.00 0.13 C ATOM 918 C ILE A 55 -1.582 8.383 -4.384 1.00 0.14 C ATOM 919 O ILE A 55 -2.670 8.609 -4.919 1.00 0.15 O ATOM 920 CB ILE A 55 -0.197 6.713 -5.583 1.00 0.16 C ATOM 921 CG1 ILE A 55 -1.099 6.199 -6.712 1.00 0.17 C ATOM 922 CG2 ILE A 55 0.928 5.735 -5.291 1.00 0.21 C ATOM 923 CD1 ILE A 55 -0.562 6.480 -8.096 1.00 0.46 C ATOM 0 H ILE A 55 -2.551 5.720 -5.029 1.00 0.12 H new ATOM 0 HA ILE A 55 -0.378 6.854 -3.443 1.00 0.13 H new ATOM 0 HB ILE A 55 0.249 7.652 -5.909 1.00 0.16 H new ATOM 0 HG12 ILE A 55 -1.234 5.124 -6.596 1.00 0.17 H new ATOM 0 HG13 ILE A 55 -2.084 6.656 -6.615 1.00 0.17 H new ATOM 0 HG21 ILE A 55 1.506 5.563 -6.199 1.00 0.21 H new ATOM 0 HG22 ILE A 55 1.578 6.148 -4.520 1.00 0.21 H new ATOM 0 HG23 ILE A 55 0.508 4.791 -4.944 1.00 0.21 H new ATOM 0 HD11 ILE A 55 -1.254 6.087 -8.841 1.00 0.46 H new ATOM 0 HD12 ILE A 55 -0.454 7.556 -8.233 1.00 0.46 H new ATOM 0 HD13 ILE A 55 0.409 6.000 -8.214 1.00 0.46 H new ATOM 935 N VAL A 56 -0.832 9.323 -3.845 1.00 0.14 N ATOM 936 CA VAL A 56 -1.228 10.710 -3.828 1.00 0.15 C ATOM 937 C VAL A 56 -0.113 11.563 -4.420 1.00 0.16 C ATOM 938 O VAL A 56 1.048 11.396 -4.069 1.00 0.18 O ATOM 939 CB VAL A 56 -1.534 11.173 -2.387 1.00 0.15 C ATOM 940 CG1 VAL A 56 -2.243 12.512 -2.403 1.00 0.17 C ATOM 941 CG2 VAL A 56 -2.365 10.136 -1.639 1.00 0.15 C ATOM 0 H VAL A 56 0.071 9.142 -3.406 1.00 0.14 H new ATOM 0 HA VAL A 56 -2.133 10.824 -4.425 1.00 0.15 H new ATOM 0 HB VAL A 56 -0.587 11.285 -1.860 1.00 0.15 H new ATOM 0 HG11 VAL A 56 -2.452 12.825 -1.380 1.00 0.17 H new ATOM 0 HG12 VAL A 56 -1.608 13.254 -2.887 1.00 0.17 H new ATOM 0 HG13 VAL A 56 -3.180 12.421 -2.953 1.00 0.17 H new ATOM 0 HG21 VAL A 56 -2.564 10.490 -0.628 1.00 0.15 H new ATOM 0 HG22 VAL A 56 -3.309 9.980 -2.162 1.00 0.15 H new ATOM 0 HG23 VAL A 56 -1.817 9.195 -1.592 1.00 0.15 H new ATOM 951 N PRO A 57 -0.442 12.482 -5.333 1.00 0.17 N ATOM 952 CA PRO A 57 0.553 13.339 -5.988 1.00 0.19 C ATOM 953 C PRO A 57 1.043 14.510 -5.130 1.00 0.19 C ATOM 954 O PRO A 57 1.799 15.353 -5.610 1.00 0.21 O ATOM 955 CB PRO A 57 -0.200 13.855 -7.210 1.00 0.23 C ATOM 956 CG PRO A 57 -1.629 13.879 -6.796 1.00 0.23 C ATOM 957 CD PRO A 57 -1.808 12.743 -5.824 1.00 0.19 C ATOM 0 HA PRO A 57 1.465 12.784 -6.208 1.00 0.19 H new ATOM 0 HB2 PRO A 57 0.145 14.848 -7.497 1.00 0.23 H new ATOM 0 HB3 PRO A 57 -0.049 13.204 -8.071 1.00 0.23 H new ATOM 0 HG2 PRO A 57 -1.883 14.832 -6.331 1.00 0.23 H new ATOM 0 HG3 PRO A 57 -2.285 13.760 -7.658 1.00 0.23 H new ATOM 0 HD2 PRO A 57 -2.480 13.015 -5.010 1.00 0.19 H new ATOM 0 HD3 PRO A 57 -2.233 11.865 -6.309 1.00 0.19 H new ATOM 965 N GLU A 58 0.626 14.567 -3.871 1.00 0.19 N ATOM 966 CA GLU A 58 1.039 15.642 -2.988 1.00 0.22 C ATOM 967 C GLU A 58 0.859 15.233 -1.537 1.00 0.21 C ATOM 968 O GLU A 58 -0.161 14.652 -1.171 1.00 0.19 O ATOM 969 CB GLU A 58 0.233 16.908 -3.277 1.00 0.26 C ATOM 970 CG GLU A 58 0.779 18.144 -2.587 1.00 0.62 C ATOM 971 CD GLU A 58 -0.215 19.280 -2.569 1.00 1.03 C ATOM 972 OE1 GLU A 58 -1.387 19.037 -2.228 1.00 1.85 O ATOM 973 OE2 GLU A 58 0.177 20.423 -2.886 1.00 1.62 O ATOM 0 H GLU A 58 0.004 13.882 -3.443 1.00 0.19 H new ATOM 0 HA GLU A 58 2.094 15.848 -3.167 1.00 0.22 H new ATOM 0 HB2 GLU A 58 0.216 17.080 -4.353 1.00 0.26 H new ATOM 0 HB3 GLU A 58 -0.799 16.752 -2.962 1.00 0.26 H new ATOM 0 HG2 GLU A 58 1.057 17.892 -1.564 1.00 0.62 H new ATOM 0 HG3 GLU A 58 1.688 18.468 -3.094 1.00 0.62 H new ATOM 980 N LYS A 59 1.857 15.535 -0.722 1.00 0.24 N ATOM 981 CA LYS A 59 1.819 15.208 0.701 1.00 0.25 C ATOM 982 C LYS A 59 0.629 15.880 1.393 1.00 0.25 C ATOM 983 O LYS A 59 0.053 15.332 2.341 1.00 0.25 O ATOM 984 CB LYS A 59 3.137 15.616 1.385 1.00 0.31 C ATOM 985 CG LYS A 59 3.273 17.114 1.643 1.00 0.47 C ATOM 986 CD LYS A 59 4.255 17.778 0.687 1.00 1.09 C ATOM 987 CE LYS A 59 5.699 17.556 1.117 1.00 1.71 C ATOM 988 NZ LYS A 59 6.657 18.342 0.293 1.00 2.18 N ATOM 0 H LYS A 59 2.710 16.009 -1.021 1.00 0.24 H new ATOM 0 HA LYS A 59 1.697 14.129 0.792 1.00 0.25 H new ATOM 0 HB2 LYS A 59 3.219 15.087 2.334 1.00 0.31 H new ATOM 0 HB3 LYS A 59 3.971 15.289 0.764 1.00 0.31 H new ATOM 0 HG2 LYS A 59 2.296 17.588 1.544 1.00 0.47 H new ATOM 0 HG3 LYS A 59 3.603 17.275 2.669 1.00 0.47 H new ATOM 0 HD2 LYS A 59 4.110 17.381 -0.318 1.00 1.09 H new ATOM 0 HD3 LYS A 59 4.050 18.847 0.640 1.00 1.09 H new ATOM 0 HE2 LYS A 59 5.811 17.833 2.165 1.00 1.71 H new ATOM 0 HE3 LYS A 59 5.941 16.496 1.040 1.00 1.71 H new ATOM 0 HZ1 LYS A 59 7.627 18.160 0.621 1.00 2.18 H new ATOM 0 HZ2 LYS A 59 6.570 18.060 -0.704 1.00 2.18 H new ATOM 0 HZ3 LYS A 59 6.444 19.356 0.386 1.00 2.18 H new ATOM 1002 N LYS A 60 0.237 17.048 0.893 1.00 0.27 N ATOM 1003 CA LYS A 60 -0.881 17.780 1.469 1.00 0.28 C ATOM 1004 C LYS A 60 -2.170 17.052 1.139 1.00 0.25 C ATOM 1005 O LYS A 60 -2.997 16.784 2.019 1.00 0.26 O ATOM 1006 CB LYS A 60 -0.916 19.212 0.942 1.00 0.34 C ATOM 1007 CG LYS A 60 0.359 19.988 1.226 1.00 0.92 C ATOM 1008 CD LYS A 60 0.135 21.483 1.115 1.00 1.61 C ATOM 1009 CE LYS A 60 1.417 22.255 1.384 1.00 2.20 C ATOM 1010 NZ LYS A 60 1.232 23.722 1.225 1.00 2.58 N ATOM 0 H LYS A 60 0.676 17.505 0.094 1.00 0.27 H new ATOM 0 HA LYS A 60 -0.763 17.831 2.551 1.00 0.28 H new ATOM 0 HB2 LYS A 60 -1.089 19.192 -0.134 1.00 0.34 H new ATOM 0 HB3 LYS A 60 -1.760 19.736 1.390 1.00 0.34 H new ATOM 0 HG2 LYS A 60 0.718 19.746 2.226 1.00 0.92 H new ATOM 0 HG3 LYS A 60 1.136 19.682 0.525 1.00 0.92 H new ATOM 0 HD2 LYS A 60 -0.235 21.724 0.119 1.00 1.61 H new ATOM 0 HD3 LYS A 60 -0.633 21.791 1.824 1.00 1.61 H new ATOM 0 HE2 LYS A 60 1.762 22.041 2.395 1.00 2.20 H new ATOM 0 HE3 LYS A 60 2.195 21.912 0.702 1.00 2.20 H new ATOM 0 HZ1 LYS A 60 2.131 24.208 1.418 1.00 2.58 H new ATOM 0 HZ2 LYS A 60 0.927 23.930 0.253 1.00 2.58 H new ATOM 0 HZ3 LYS A 60 0.508 24.055 1.893 1.00 2.58 H new ATOM 1024 N LEU A 61 -2.322 16.699 -0.137 1.00 0.23 N ATOM 1025 CA LEU A 61 -3.493 15.976 -0.587 1.00 0.22 C ATOM 1026 C LEU A 61 -3.581 14.649 0.152 1.00 0.20 C ATOM 1027 O LEU A 61 -4.659 14.154 0.415 1.00 0.20 O ATOM 1028 CB LEU A 61 -3.431 15.733 -2.101 1.00 0.23 C ATOM 1029 CG LEU A 61 -4.783 15.498 -2.781 1.00 0.34 C ATOM 1030 CD1 LEU A 61 -5.681 16.719 -2.643 1.00 0.55 C ATOM 1031 CD2 LEU A 61 -4.584 15.147 -4.248 1.00 0.28 C ATOM 0 H LEU A 61 -1.645 16.906 -0.871 1.00 0.23 H new ATOM 0 HA LEU A 61 -4.381 16.572 -0.374 1.00 0.22 H new ATOM 0 HB2 LEU A 61 -2.951 16.591 -2.571 1.00 0.23 H new ATOM 0 HB3 LEU A 61 -2.793 14.869 -2.288 1.00 0.23 H new ATOM 0 HG LEU A 61 -5.272 14.660 -2.285 1.00 0.34 H new ATOM 0 HD11 LEU A 61 -6.635 16.527 -3.134 1.00 0.55 H new ATOM 0 HD12 LEU A 61 -5.852 16.927 -1.587 1.00 0.55 H new ATOM 0 HD13 LEU A 61 -5.200 17.579 -3.109 1.00 0.55 H new ATOM 0 HD21 LEU A 61 -5.554 14.983 -4.718 1.00 0.28 H new ATOM 0 HD22 LEU A 61 -4.071 15.966 -4.752 1.00 0.28 H new ATOM 0 HD23 LEU A 61 -3.984 14.240 -4.327 1.00 0.28 H new ATOM 1043 N LEU A 62 -2.419 14.085 0.472 1.00 0.18 N ATOM 1044 CA LEU A 62 -2.333 12.829 1.204 1.00 0.18 C ATOM 1045 C LEU A 62 -2.936 12.969 2.592 1.00 0.20 C ATOM 1046 O LEU A 62 -3.794 12.186 2.995 1.00 0.21 O ATOM 1047 CB LEU A 62 -0.868 12.412 1.319 1.00 0.19 C ATOM 1048 CG LEU A 62 -0.626 10.953 1.705 1.00 0.20 C ATOM 1049 CD1 LEU A 62 0.707 10.479 1.162 1.00 0.23 C ATOM 1050 CD2 LEU A 62 -0.662 10.779 3.216 1.00 0.25 C ATOM 0 H LEU A 62 -1.513 14.487 0.231 1.00 0.18 H new ATOM 0 HA LEU A 62 -2.895 12.068 0.662 1.00 0.18 H new ATOM 0 HB2 LEU A 62 -0.378 12.603 0.364 1.00 0.19 H new ATOM 0 HB3 LEU A 62 -0.384 13.050 2.058 1.00 0.19 H new ATOM 0 HG LEU A 62 -1.423 10.351 1.268 1.00 0.20 H new ATOM 0 HD11 LEU A 62 0.866 9.438 1.445 1.00 0.23 H new ATOM 0 HD12 LEU A 62 0.708 10.564 0.075 1.00 0.23 H new ATOM 0 HD13 LEU A 62 1.507 11.093 1.575 1.00 0.23 H new ATOM 0 HD21 LEU A 62 -0.487 9.733 3.466 1.00 0.25 H new ATOM 0 HD22 LEU A 62 0.113 11.395 3.672 1.00 0.25 H new ATOM 0 HD23 LEU A 62 -1.638 11.084 3.594 1.00 0.25 H new ATOM 1062 N LYS A 63 -2.494 13.988 3.309 1.00 0.22 N ATOM 1063 CA LYS A 63 -2.981 14.238 4.662 1.00 0.26 C ATOM 1064 C LYS A 63 -4.464 14.599 4.667 1.00 0.24 C ATOM 1065 O LYS A 63 -5.160 14.420 5.664 1.00 0.27 O ATOM 1066 CB LYS A 63 -2.178 15.368 5.297 1.00 0.33 C ATOM 1067 CG LYS A 63 -0.740 14.995 5.589 1.00 0.40 C ATOM 1068 CD LYS A 63 -0.002 16.127 6.284 1.00 0.56 C ATOM 1069 CE LYS A 63 1.408 15.713 6.666 1.00 1.38 C ATOM 1070 NZ LYS A 63 1.414 14.650 7.706 1.00 2.15 N ATOM 0 H LYS A 63 -1.799 14.658 2.980 1.00 0.22 H new ATOM 0 HA LYS A 63 -2.854 13.322 5.239 1.00 0.26 H new ATOM 0 HB2 LYS A 63 -2.193 16.232 4.633 1.00 0.33 H new ATOM 0 HB3 LYS A 63 -2.663 15.671 6.225 1.00 0.33 H new ATOM 0 HG2 LYS A 63 -0.714 14.103 6.216 1.00 0.40 H new ATOM 0 HG3 LYS A 63 -0.231 14.745 4.658 1.00 0.40 H new ATOM 0 HD2 LYS A 63 0.037 16.996 5.627 1.00 0.56 H new ATOM 0 HD3 LYS A 63 -0.550 16.427 7.177 1.00 0.56 H new ATOM 0 HE2 LYS A 63 1.934 15.357 5.780 1.00 1.38 H new ATOM 0 HE3 LYS A 63 1.954 16.582 7.033 1.00 1.38 H new ATOM 0 HZ1 LYS A 63 2.205 14.810 8.362 1.00 2.15 H new ATOM 0 HZ2 LYS A 63 0.517 14.674 8.233 1.00 2.15 H new ATOM 0 HZ3 LYS A 63 1.524 13.721 7.252 1.00 2.15 H new ATOM 1084 N HIS A 64 -4.929 15.111 3.545 1.00 0.22 N ATOM 1085 CA HIS A 64 -6.319 15.528 3.398 1.00 0.23 C ATOM 1086 C HIS A 64 -7.073 14.643 2.406 1.00 0.19 C ATOM 1087 O HIS A 64 -8.078 15.056 1.836 1.00 0.20 O ATOM 1088 CB HIS A 64 -6.389 16.999 2.986 1.00 0.29 C ATOM 1089 CG HIS A 64 -6.121 17.944 4.121 1.00 0.51 C ATOM 1090 ND1 HIS A 64 -7.093 18.784 4.611 1.00 1.18 N ATOM 1091 CD2 HIS A 64 -4.985 18.128 4.833 1.00 1.18 C ATOM 1092 CE1 HIS A 64 -6.527 19.452 5.604 1.00 1.14 C ATOM 1093 NE2 HIS A 64 -5.252 19.087 5.776 1.00 1.11 N ATOM 0 H HIS A 64 -4.361 15.251 2.710 1.00 0.22 H new ATOM 0 HA HIS A 64 -6.808 15.413 4.365 1.00 0.23 H new ATOM 0 HB2 HIS A 64 -5.666 17.182 2.191 1.00 0.29 H new ATOM 0 HB3 HIS A 64 -7.376 17.208 2.573 1.00 0.29 H new ATOM 0 HD2 HIS A 64 -4.045 17.616 4.686 1.00 1.18 H new ATOM 0 HE1 HIS A 64 -7.031 20.198 6.200 1.00 1.14 H new ATOM 0 HE2 HIS A 64 -4.603 19.452 6.474 1.00 1.11 H new ATOM 1101 N VAL A 65 -6.548 13.446 2.174 1.00 0.18 N ATOM 1102 CA VAL A 65 -7.134 12.506 1.226 1.00 0.18 C ATOM 1103 C VAL A 65 -8.221 11.650 1.869 1.00 0.19 C ATOM 1104 O VAL A 65 -9.030 11.031 1.177 1.00 0.22 O ATOM 1105 CB VAL A 65 -6.050 11.600 0.595 1.00 0.19 C ATOM 1106 CG1 VAL A 65 -5.833 10.333 1.407 1.00 0.23 C ATOM 1107 CG2 VAL A 65 -6.401 11.269 -0.846 1.00 0.21 C ATOM 0 H VAL A 65 -5.707 13.100 2.636 1.00 0.18 H new ATOM 0 HA VAL A 65 -7.597 13.101 0.439 1.00 0.18 H new ATOM 0 HB VAL A 65 -5.111 12.154 0.603 1.00 0.19 H new ATOM 0 HG11 VAL A 65 -5.065 9.723 0.932 1.00 0.23 H new ATOM 0 HG12 VAL A 65 -5.514 10.597 2.415 1.00 0.23 H new ATOM 0 HG13 VAL A 65 -6.764 9.769 1.457 1.00 0.23 H new ATOM 0 HG21 VAL A 65 -5.626 10.631 -1.272 1.00 0.21 H new ATOM 0 HG22 VAL A 65 -7.358 10.748 -0.877 1.00 0.21 H new ATOM 0 HG23 VAL A 65 -6.471 12.190 -1.424 1.00 0.21 H new ATOM 1117 N LEU A 66 -8.249 11.616 3.198 1.00 0.21 N ATOM 1118 CA LEU A 66 -9.255 10.831 3.907 1.00 0.25 C ATOM 1119 C LEU A 66 -10.218 11.706 4.740 1.00 0.24 C ATOM 1120 O LEU A 66 -10.567 11.332 5.861 1.00 0.28 O ATOM 1121 CB LEU A 66 -8.556 9.816 4.815 1.00 0.33 C ATOM 1122 CG LEU A 66 -9.394 8.598 5.199 1.00 1.22 C ATOM 1123 CD1 LEU A 66 -9.354 7.552 4.095 1.00 2.00 C ATOM 1124 CD2 LEU A 66 -8.905 8.011 6.514 1.00 2.15 C ATOM 0 H LEU A 66 -7.595 12.116 3.800 1.00 0.21 H new ATOM 0 HA LEU A 66 -9.860 10.320 3.158 1.00 0.25 H new ATOM 0 HB2 LEU A 66 -7.650 9.471 4.317 1.00 0.33 H new ATOM 0 HB3 LEU A 66 -8.244 10.324 5.727 1.00 0.33 H new ATOM 0 HG LEU A 66 -10.428 8.917 5.329 1.00 1.22 H new ATOM 0 HD11 LEU A 66 -9.957 6.692 4.387 1.00 2.00 H new ATOM 0 HD12 LEU A 66 -9.753 7.979 3.175 1.00 2.00 H new ATOM 0 HD13 LEU A 66 -8.324 7.235 3.932 1.00 2.00 H new ATOM 0 HD21 LEU A 66 -9.512 7.144 6.774 1.00 2.15 H new ATOM 0 HD22 LEU A 66 -7.863 7.707 6.412 1.00 2.15 H new ATOM 0 HD23 LEU A 66 -8.988 8.761 7.301 1.00 2.15 H new ATOM 1136 N PRO A 67 -10.673 12.880 4.234 1.00 0.20 N ATOM 1137 CA PRO A 67 -11.607 13.720 4.980 1.00 0.21 C ATOM 1138 C PRO A 67 -13.001 13.089 5.070 1.00 0.21 C ATOM 1139 O PRO A 67 -13.455 12.727 6.157 1.00 0.24 O ATOM 1140 CB PRO A 67 -11.648 15.028 4.187 1.00 0.20 C ATOM 1141 CG PRO A 67 -11.235 14.657 2.810 1.00 0.18 C ATOM 1142 CD PRO A 67 -10.299 13.498 2.950 1.00 0.18 C ATOM 0 HA PRO A 67 -11.291 13.860 6.014 1.00 0.21 H new ATOM 0 HB2 PRO A 67 -12.647 15.463 4.195 1.00 0.20 H new ATOM 0 HB3 PRO A 67 -10.974 15.770 4.615 1.00 0.20 H new ATOM 0 HG2 PRO A 67 -12.100 14.387 2.204 1.00 0.18 H new ATOM 0 HG3 PRO A 67 -10.746 15.494 2.312 1.00 0.18 H new ATOM 0 HD2 PRO A 67 -10.409 12.796 2.124 1.00 0.18 H new ATOM 0 HD3 PRO A 67 -9.259 13.825 2.954 1.00 0.18 H new ATOM 1150 N ASN A 68 -13.687 12.945 3.932 1.00 0.20 N ATOM 1151 CA ASN A 68 -15.014 12.347 3.936 1.00 0.21 C ATOM 1152 C ASN A 68 -15.092 11.215 2.934 1.00 0.19 C ATOM 1153 O ASN A 68 -15.737 11.337 1.896 1.00 0.18 O ATOM 1154 CB ASN A 68 -16.091 13.385 3.621 1.00 0.23 C ATOM 1155 CG ASN A 68 -16.153 14.505 4.636 1.00 0.27 C ATOM 1156 OD1 ASN A 68 -16.763 14.364 5.697 1.00 0.33 O ATOM 1157 ND2 ASN A 68 -15.527 15.627 4.317 1.00 0.27 N ATOM 0 H ASN A 68 -13.348 13.231 3.013 1.00 0.20 H new ATOM 0 HA ASN A 68 -15.193 11.954 4.937 1.00 0.21 H new ATOM 0 HB2 ASN A 68 -15.902 13.808 2.634 1.00 0.23 H new ATOM 0 HB3 ASN A 68 -17.061 12.890 3.575 1.00 0.23 H new ATOM 0 HD21 ASN A 68 -15.538 16.418 4.961 1.00 0.27 H new ATOM 0 HD22 ASN A 68 -15.034 15.701 3.427 1.00 0.27 H new ATOM 1164 N ILE A 69 -14.429 10.116 3.242 1.00 0.18 N ATOM 1165 CA ILE A 69 -14.433 8.963 2.360 1.00 0.17 C ATOM 1166 C ILE A 69 -15.756 8.188 2.462 1.00 0.18 C ATOM 1167 O ILE A 69 -16.303 7.993 3.554 1.00 0.20 O ATOM 1168 CB ILE A 69 -13.231 8.043 2.688 1.00 0.19 C ATOM 1169 CG1 ILE A 69 -13.078 6.955 1.631 1.00 0.19 C ATOM 1170 CG2 ILE A 69 -13.353 7.440 4.080 1.00 0.22 C ATOM 1171 CD1 ILE A 69 -12.567 7.493 0.317 1.00 0.28 C ATOM 0 H ILE A 69 -13.882 9.997 4.094 1.00 0.18 H new ATOM 0 HA ILE A 69 -14.338 9.316 1.333 1.00 0.17 H new ATOM 0 HB ILE A 69 -12.331 8.657 2.677 1.00 0.19 H new ATOM 0 HG12 ILE A 69 -12.393 6.191 1.998 1.00 0.19 H new ATOM 0 HG13 ILE A 69 -14.041 6.470 1.471 1.00 0.19 H new ATOM 0 HG21 ILE A 69 -12.493 6.800 4.276 1.00 0.22 H new ATOM 0 HG22 ILE A 69 -13.388 8.239 4.821 1.00 0.22 H new ATOM 0 HG23 ILE A 69 -14.266 6.848 4.141 1.00 0.22 H new ATOM 0 HD11 ILE A 69 -12.477 6.677 -0.400 1.00 0.28 H new ATOM 0 HD12 ILE A 69 -13.264 8.238 -0.067 1.00 0.28 H new ATOM 0 HD13 ILE A 69 -11.591 7.954 0.467 1.00 0.28 H new ATOM 1183 N ARG A 70 -16.284 7.795 1.302 1.00 0.17 N ATOM 1184 CA ARG A 70 -17.541 7.061 1.218 1.00 0.20 C ATOM 1185 C ARG A 70 -17.512 6.069 0.048 1.00 0.17 C ATOM 1186 O ARG A 70 -16.815 6.285 -0.951 1.00 0.17 O ATOM 1187 CB ARG A 70 -18.704 8.043 1.035 1.00 0.25 C ATOM 1188 CG ARG A 70 -20.040 7.521 1.542 1.00 1.04 C ATOM 1189 CD ARG A 70 -21.186 8.444 1.150 1.00 1.23 C ATOM 1190 NE ARG A 70 -20.993 9.814 1.638 1.00 1.76 N ATOM 1191 CZ ARG A 70 -21.976 10.597 2.089 1.00 2.27 C ATOM 1192 NH1 ARG A 70 -23.213 10.127 2.202 1.00 2.45 N ATOM 1193 NH2 ARG A 70 -21.717 11.850 2.444 1.00 3.18 N ATOM 0 H ARG A 70 -15.851 7.978 0.397 1.00 0.17 H new ATOM 0 HA ARG A 70 -17.678 6.502 2.144 1.00 0.20 H new ATOM 0 HB2 ARG A 70 -18.467 8.971 1.555 1.00 0.25 H new ATOM 0 HB3 ARG A 70 -18.798 8.285 -0.024 1.00 0.25 H new ATOM 0 HG2 ARG A 70 -20.219 6.525 1.138 1.00 1.04 H new ATOM 0 HG3 ARG A 70 -20.005 7.423 2.627 1.00 1.04 H new ATOM 0 HD2 ARG A 70 -21.282 8.458 0.064 1.00 1.23 H new ATOM 0 HD3 ARG A 70 -22.120 8.048 1.548 1.00 1.23 H new ATOM 0 HE ARG A 70 -20.046 10.193 1.632 1.00 1.76 H new ATOM 0 HH11 ARG A 70 -23.417 9.162 1.943 1.00 2.45 H new ATOM 0 HH12 ARG A 70 -23.959 10.731 2.547 1.00 2.45 H new ATOM 0 HH21 ARG A 70 -20.767 12.214 2.372 1.00 3.18 H new ATOM 0 HH22 ARG A 70 -22.468 12.448 2.788 1.00 3.18 H new ATOM 1207 N ILE A 71 -18.263 4.981 0.186 1.00 0.18 N ATOM 1208 CA ILE A 71 -18.344 3.955 -0.854 1.00 0.17 C ATOM 1209 C ILE A 71 -19.742 3.931 -1.461 1.00 0.18 C ATOM 1210 O ILE A 71 -20.708 4.355 -0.830 1.00 0.21 O ATOM 1211 CB ILE A 71 -17.985 2.556 -0.292 1.00 0.17 C ATOM 1212 CG1 ILE A 71 -16.576 2.581 0.287 1.00 0.18 C ATOM 1213 CG2 ILE A 71 -18.080 1.483 -1.372 1.00 0.20 C ATOM 1214 CD1 ILE A 71 -16.180 1.306 1.000 1.00 0.19 C ATOM 0 H ILE A 71 -18.828 4.784 1.012 1.00 0.18 H new ATOM 0 HA ILE A 71 -17.620 4.205 -1.630 1.00 0.17 H new ATOM 0 HB ILE A 71 -18.701 2.311 0.492 1.00 0.17 H new ATOM 0 HG12 ILE A 71 -15.867 2.770 -0.519 1.00 0.18 H new ATOM 0 HG13 ILE A 71 -16.496 3.415 0.984 1.00 0.18 H new ATOM 0 HG21 ILE A 71 -17.822 0.514 -0.945 1.00 0.20 H new ATOM 0 HG22 ILE A 71 -19.097 1.449 -1.762 1.00 0.20 H new ATOM 0 HG23 ILE A 71 -17.389 1.719 -2.181 1.00 0.20 H new ATOM 0 HD11 ILE A 71 -15.164 1.404 1.383 1.00 0.19 H new ATOM 0 HD12 ILE A 71 -16.865 1.125 1.829 1.00 0.19 H new ATOM 0 HD13 ILE A 71 -16.226 0.470 0.302 1.00 0.19 H new ATOM 1226 N LYS A 72 -19.844 3.433 -2.683 1.00 0.18 N ATOM 1227 CA LYS A 72 -21.114 3.370 -3.367 1.00 0.21 C ATOM 1228 C LYS A 72 -21.652 1.957 -3.377 1.00 0.20 C ATOM 1229 O LYS A 72 -21.311 1.126 -4.219 1.00 0.26 O ATOM 1230 CB LYS A 72 -21.000 3.859 -4.794 1.00 0.30 C ATOM 1231 CG LYS A 72 -20.368 5.233 -4.938 1.00 0.41 C ATOM 1232 CD LYS A 72 -21.329 6.325 -4.495 1.00 0.78 C ATOM 1233 CE LYS A 72 -20.743 7.711 -4.708 1.00 1.53 C ATOM 1234 NZ LYS A 72 -21.696 8.781 -4.311 1.00 2.05 N ATOM 0 H LYS A 72 -19.057 3.067 -3.218 1.00 0.18 H new ATOM 0 HA LYS A 72 -21.799 4.019 -2.822 1.00 0.21 H new ATOM 0 HB2 LYS A 72 -20.412 3.141 -5.366 1.00 0.30 H new ATOM 0 HB3 LYS A 72 -21.995 3.882 -5.238 1.00 0.30 H new ATOM 0 HG2 LYS A 72 -19.457 5.282 -4.342 1.00 0.41 H new ATOM 0 HG3 LYS A 72 -20.079 5.397 -5.976 1.00 0.41 H new ATOM 0 HD2 LYS A 72 -22.262 6.235 -5.051 1.00 0.78 H new ATOM 0 HD3 LYS A 72 -21.571 6.191 -3.441 1.00 0.78 H new ATOM 0 HE2 LYS A 72 -19.824 7.810 -4.130 1.00 1.53 H new ATOM 0 HE3 LYS A 72 -20.474 7.835 -5.757 1.00 1.53 H new ATOM 0 HZ1 LYS A 72 -21.260 9.711 -4.471 1.00 2.05 H new ATOM 0 HZ2 LYS A 72 -22.563 8.703 -4.880 1.00 2.05 H new ATOM 0 HZ3 LYS A 72 -21.933 8.679 -3.304 1.00 2.05 H new ATOM 1248 N GLY A 73 -22.465 1.719 -2.403 1.00 0.20 N ATOM 1249 CA GLY A 73 -23.153 0.446 -2.258 1.00 0.25 C ATOM 1250 C GLY A 73 -22.584 -0.458 -1.184 1.00 0.22 C ATOM 1251 O GLY A 73 -22.914 -1.642 -1.133 1.00 0.25 O ATOM 0 H GLY A 73 -22.683 2.396 -1.672 1.00 0.20 H new ATOM 0 HA2 GLY A 73 -24.202 0.638 -2.035 1.00 0.25 H new ATOM 0 HA3 GLY A 73 -23.121 -0.080 -3.212 1.00 0.25 H new ATOM 1255 N LEU A 74 -21.734 0.077 -0.327 1.00 0.17 N ATOM 1256 CA LEU A 74 -21.143 -0.716 0.734 1.00 0.15 C ATOM 1257 C LEU A 74 -20.819 0.155 1.944 1.00 0.15 C ATOM 1258 O LEU A 74 -20.638 1.368 1.810 1.00 0.15 O ATOM 1259 CB LEU A 74 -19.897 -1.402 0.182 1.00 0.16 C ATOM 1260 CG LEU A 74 -18.818 -1.770 1.189 1.00 0.15 C ATOM 1261 CD1 LEU A 74 -19.209 -3.022 1.946 1.00 0.16 C ATOM 1262 CD2 LEU A 74 -17.492 -1.984 0.489 1.00 0.18 C ATOM 0 H LEU A 74 -21.439 1.053 -0.345 1.00 0.17 H new ATOM 0 HA LEU A 74 -21.848 -1.474 1.075 1.00 0.15 H new ATOM 0 HB2 LEU A 74 -20.208 -2.312 -0.331 1.00 0.16 H new ATOM 0 HB3 LEU A 74 -19.453 -0.749 -0.569 1.00 0.16 H new ATOM 0 HG LEU A 74 -18.714 -0.947 1.896 1.00 0.15 H new ATOM 0 HD11 LEU A 74 -18.427 -3.273 2.663 1.00 0.16 H new ATOM 0 HD12 LEU A 74 -20.146 -2.849 2.476 1.00 0.16 H new ATOM 0 HD13 LEU A 74 -19.336 -3.847 1.245 1.00 0.16 H new ATOM 0 HD21 LEU A 74 -16.731 -2.247 1.224 1.00 0.18 H new ATOM 0 HD22 LEU A 74 -17.590 -2.791 -0.237 1.00 0.18 H new ATOM 0 HD23 LEU A 74 -17.200 -1.068 -0.025 1.00 0.18 H new ATOM 1274 N SER A 75 -20.760 -0.459 3.119 1.00 0.15 N ATOM 1275 CA SER A 75 -20.467 0.273 4.336 1.00 0.15 C ATOM 1276 C SER A 75 -19.042 -0.011 4.782 1.00 0.14 C ATOM 1277 O SER A 75 -18.452 -0.998 4.360 1.00 0.14 O ATOM 1278 CB SER A 75 -21.463 -0.111 5.422 1.00 0.17 C ATOM 1279 OG SER A 75 -22.429 0.909 5.612 1.00 0.29 O ATOM 0 H SER A 75 -20.911 -1.459 3.251 1.00 0.15 H new ATOM 0 HA SER A 75 -20.559 1.342 4.146 1.00 0.15 H new ATOM 0 HB2 SER A 75 -21.961 -1.042 5.150 1.00 0.17 H new ATOM 0 HB3 SER A 75 -20.934 -0.294 6.357 1.00 0.17 H new ATOM 0 HG SER A 75 -23.058 0.638 6.313 1.00 0.29 H new ATOM 1285 N PHE A 76 -18.475 0.871 5.592 1.00 0.15 N ATOM 1286 CA PHE A 76 -17.116 0.690 6.069 1.00 0.16 C ATOM 1287 C PHE A 76 -16.785 1.669 7.183 1.00 0.18 C ATOM 1288 O PHE A 76 -17.538 2.602 7.459 1.00 0.23 O ATOM 1289 CB PHE A 76 -16.115 0.857 4.918 1.00 0.15 C ATOM 1290 CG PHE A 76 -15.996 2.265 4.407 1.00 0.16 C ATOM 1291 CD1 PHE A 76 -17.100 2.933 3.899 1.00 1.21 C ATOM 1292 CD2 PHE A 76 -14.775 2.915 4.425 1.00 1.19 C ATOM 1293 CE1 PHE A 76 -16.989 4.220 3.421 1.00 1.23 C ATOM 1294 CE2 PHE A 76 -14.657 4.205 3.947 1.00 1.20 C ATOM 1295 CZ PHE A 76 -15.765 4.857 3.444 1.00 0.22 C ATOM 0 H PHE A 76 -18.935 1.716 5.931 1.00 0.15 H new ATOM 0 HA PHE A 76 -17.040 -0.322 6.467 1.00 0.16 H new ATOM 0 HB2 PHE A 76 -15.134 0.519 5.252 1.00 0.15 H new ATOM 0 HB3 PHE A 76 -16.413 0.207 4.095 1.00 0.15 H new ATOM 0 HD1 PHE A 76 -18.059 2.438 3.878 1.00 1.21 H new ATOM 0 HD2 PHE A 76 -13.905 2.408 4.817 1.00 1.19 H new ATOM 0 HE1 PHE A 76 -17.857 4.729 3.029 1.00 1.23 H new ATOM 0 HE2 PHE A 76 -13.699 4.703 3.967 1.00 1.20 H new ATOM 0 HZ PHE A 76 -15.674 5.866 3.069 1.00 0.22 H new ATOM 1305 N SER A 77 -15.649 1.435 7.808 1.00 0.19 N ATOM 1306 CA SER A 77 -15.142 2.284 8.871 1.00 0.21 C ATOM 1307 C SER A 77 -13.635 2.380 8.700 1.00 0.20 C ATOM 1308 O SER A 77 -12.960 1.355 8.641 1.00 0.21 O ATOM 1309 CB SER A 77 -15.503 1.712 10.240 1.00 0.25 C ATOM 1310 OG SER A 77 -15.984 0.378 10.127 1.00 0.34 O ATOM 0 H SER A 77 -15.044 0.643 7.591 1.00 0.19 H new ATOM 0 HA SER A 77 -15.591 3.275 8.814 1.00 0.21 H new ATOM 0 HB2 SER A 77 -14.627 1.732 10.889 1.00 0.25 H new ATOM 0 HB3 SER A 77 -16.262 2.337 10.710 1.00 0.25 H new ATOM 0 HG SER A 77 -16.207 0.034 11.017 1.00 0.34 H new ATOM 1316 N VAL A 78 -13.108 3.592 8.602 1.00 0.23 N ATOM 1317 CA VAL A 78 -11.682 3.776 8.374 1.00 0.25 C ATOM 1318 C VAL A 78 -10.971 4.457 9.545 1.00 0.22 C ATOM 1319 O VAL A 78 -11.539 5.304 10.238 1.00 0.26 O ATOM 1320 CB VAL A 78 -11.442 4.580 7.076 1.00 0.35 C ATOM 1321 CG1 VAL A 78 -11.938 6.013 7.220 1.00 0.42 C ATOM 1322 CG2 VAL A 78 -9.972 4.548 6.674 1.00 0.43 C ATOM 0 H VAL A 78 -13.642 4.458 8.676 1.00 0.23 H new ATOM 0 HA VAL A 78 -11.254 2.778 8.276 1.00 0.25 H new ATOM 0 HB VAL A 78 -12.016 4.106 6.280 1.00 0.35 H new ATOM 0 HG11 VAL A 78 -11.757 6.556 6.292 1.00 0.42 H new ATOM 0 HG12 VAL A 78 -13.007 6.008 7.435 1.00 0.42 H new ATOM 0 HG13 VAL A 78 -11.406 6.502 8.036 1.00 0.42 H new ATOM 0 HG21 VAL A 78 -9.833 5.122 5.758 1.00 0.43 H new ATOM 0 HG22 VAL A 78 -9.368 4.983 7.470 1.00 0.43 H new ATOM 0 HG23 VAL A 78 -9.663 3.516 6.507 1.00 0.43 H new ATOM 1332 N LYS A 79 -9.728 4.047 9.761 1.00 0.20 N ATOM 1333 CA LYS A 79 -8.883 4.598 10.808 1.00 0.21 C ATOM 1334 C LYS A 79 -7.555 5.046 10.205 1.00 0.21 C ATOM 1335 O LYS A 79 -6.796 4.225 9.689 1.00 0.26 O ATOM 1336 CB LYS A 79 -8.630 3.545 11.890 1.00 0.27 C ATOM 1337 CG LYS A 79 -9.714 3.467 12.950 1.00 1.04 C ATOM 1338 CD LYS A 79 -9.321 4.251 14.189 1.00 1.33 C ATOM 1339 CE LYS A 79 -10.181 3.881 15.384 1.00 2.05 C ATOM 1340 NZ LYS A 79 -9.626 4.433 16.645 1.00 2.54 N ATOM 0 H LYS A 79 -9.276 3.317 9.210 1.00 0.20 H new ATOM 0 HA LYS A 79 -9.386 5.453 11.260 1.00 0.21 H new ATOM 0 HB2 LYS A 79 -8.532 2.569 11.415 1.00 0.27 H new ATOM 0 HB3 LYS A 79 -7.678 3.761 12.375 1.00 0.27 H new ATOM 0 HG2 LYS A 79 -10.649 3.859 12.549 1.00 1.04 H new ATOM 0 HG3 LYS A 79 -9.893 2.425 13.216 1.00 1.04 H new ATOM 0 HD2 LYS A 79 -8.273 4.062 14.422 1.00 1.33 H new ATOM 0 HD3 LYS A 79 -9.415 5.318 13.989 1.00 1.33 H new ATOM 0 HE2 LYS A 79 -11.193 4.257 15.235 1.00 2.05 H new ATOM 0 HE3 LYS A 79 -10.252 2.796 15.461 1.00 2.05 H new ATOM 0 HZ1 LYS A 79 -10.237 4.162 17.441 1.00 2.54 H new ATOM 0 HZ2 LYS A 79 -8.669 4.055 16.798 1.00 2.54 H new ATOM 0 HZ3 LYS A 79 -9.582 5.470 16.580 1.00 2.54 H new ATOM 1354 N VAL A 80 -7.277 6.341 10.261 1.00 0.25 N ATOM 1355 CA VAL A 80 -6.039 6.877 9.702 1.00 0.26 C ATOM 1356 C VAL A 80 -4.916 6.874 10.742 1.00 0.29 C ATOM 1357 O VAL A 80 -5.116 7.259 11.899 1.00 0.40 O ATOM 1358 CB VAL A 80 -6.240 8.305 9.135 1.00 0.37 C ATOM 1359 CG1 VAL A 80 -6.762 9.253 10.202 1.00 0.50 C ATOM 1360 CG2 VAL A 80 -4.947 8.838 8.528 1.00 0.38 C ATOM 0 H VAL A 80 -7.888 7.039 10.685 1.00 0.25 H new ATOM 0 HA VAL A 80 -5.751 6.224 8.879 1.00 0.26 H new ATOM 0 HB VAL A 80 -6.988 8.244 8.345 1.00 0.37 H new ATOM 0 HG11 VAL A 80 -6.893 10.247 9.773 1.00 0.50 H new ATOM 0 HG12 VAL A 80 -7.720 8.890 10.575 1.00 0.50 H new ATOM 0 HG13 VAL A 80 -6.048 9.304 11.024 1.00 0.50 H new ATOM 0 HG21 VAL A 80 -5.115 9.842 8.137 1.00 0.38 H new ATOM 0 HG22 VAL A 80 -4.172 8.872 9.294 1.00 0.38 H new ATOM 0 HG23 VAL A 80 -4.628 8.182 7.718 1.00 0.38 H new ATOM 1370 N CYS A 81 -3.747 6.405 10.322 1.00 0.26 N ATOM 1371 CA CYS A 81 -2.573 6.326 11.176 1.00 0.33 C ATOM 1372 C CYS A 81 -1.314 6.752 10.412 1.00 0.29 C ATOM 1373 O CYS A 81 -1.110 6.378 9.238 1.00 0.25 O ATOM 1374 CB CYS A 81 -2.401 4.897 11.703 1.00 0.41 C ATOM 1375 SG CYS A 81 -3.915 4.161 12.369 1.00 1.05 S ATOM 0 H CYS A 81 -3.588 6.067 9.373 1.00 0.26 H new ATOM 0 HA CYS A 81 -2.716 7.006 12.016 1.00 0.33 H new ATOM 0 HB2 CYS A 81 -2.029 4.267 10.895 1.00 0.41 H new ATOM 0 HB3 CYS A 81 -1.639 4.899 12.482 1.00 0.41 H new ATOM 0 HG CYS A 81 -3.665 2.955 12.785 1.00 1.05 H new ATOM 1381 N GLY A 82 -0.474 7.536 11.084 1.00 0.34 N ATOM 1382 CA GLY A 82 0.753 8.009 10.480 1.00 0.35 C ATOM 1383 C GLY A 82 0.500 8.752 9.192 1.00 0.34 C ATOM 1384 O GLY A 82 -0.389 9.603 9.117 1.00 0.37 O ATOM 0 H GLY A 82 -0.626 7.852 12.042 1.00 0.34 H new ATOM 0 HA2 GLY A 82 1.273 8.664 11.180 1.00 0.35 H new ATOM 0 HA3 GLY A 82 1.412 7.162 10.287 1.00 0.35 H new ATOM 1388 N GLU A 83 1.289 8.439 8.184 1.00 0.33 N ATOM 1389 CA GLU A 83 1.137 9.059 6.886 1.00 0.33 C ATOM 1390 C GLU A 83 0.450 8.086 5.929 1.00 0.27 C ATOM 1391 O GLU A 83 -0.680 8.308 5.498 1.00 0.27 O ATOM 1392 CB GLU A 83 2.502 9.474 6.328 1.00 0.39 C ATOM 1393 CG GLU A 83 3.350 10.301 7.291 1.00 0.88 C ATOM 1394 CD GLU A 83 2.729 11.640 7.639 1.00 1.67 C ATOM 1395 OE1 GLU A 83 2.594 12.495 6.743 1.00 2.45 O ATOM 1396 OE2 GLU A 83 2.384 11.849 8.819 1.00 2.27 O ATOM 0 H GLU A 83 2.044 7.756 8.241 1.00 0.33 H new ATOM 0 HA GLU A 83 0.522 9.953 6.991 1.00 0.33 H new ATOM 0 HB2 GLU A 83 3.057 8.577 6.053 1.00 0.39 H new ATOM 0 HB3 GLU A 83 2.349 10.047 5.414 1.00 0.39 H new ATOM 0 HG2 GLU A 83 3.506 9.732 8.207 1.00 0.88 H new ATOM 0 HG3 GLU A 83 4.332 10.468 6.848 1.00 0.88 H new ATOM 1403 N ARG A 84 1.137 6.990 5.622 1.00 0.24 N ATOM 1404 CA ARG A 84 0.623 5.987 4.712 1.00 0.21 C ATOM 1405 C ARG A 84 -0.087 4.818 5.387 1.00 0.21 C ATOM 1406 O ARG A 84 -0.079 3.722 4.840 1.00 0.26 O ATOM 1407 CB ARG A 84 1.766 5.447 3.831 1.00 0.25 C ATOM 1408 CG ARG A 84 2.979 4.942 4.602 1.00 0.88 C ATOM 1409 CD ARG A 84 4.259 5.636 4.150 1.00 1.10 C ATOM 1410 NE ARG A 84 4.787 6.536 5.178 1.00 1.55 N ATOM 1411 CZ ARG A 84 5.290 7.748 4.928 1.00 2.14 C ATOM 1412 NH1 ARG A 84 5.310 8.231 3.694 1.00 2.53 N ATOM 1413 NH2 ARG A 84 5.776 8.480 5.926 1.00 2.95 N ATOM 0 H ARG A 84 2.061 6.778 5.998 1.00 0.24 H new ATOM 0 HA ARG A 84 -0.133 6.496 4.114 1.00 0.21 H new ATOM 0 HB2 ARG A 84 1.380 4.635 3.216 1.00 0.25 H new ATOM 0 HB3 ARG A 84 2.087 6.237 3.152 1.00 0.25 H new ATOM 0 HG2 ARG A 84 2.830 5.111 5.668 1.00 0.88 H new ATOM 0 HG3 ARG A 84 3.078 3.866 4.461 1.00 0.88 H new ATOM 0 HD2 ARG A 84 5.011 4.886 3.904 1.00 1.10 H new ATOM 0 HD3 ARG A 84 4.063 6.201 3.239 1.00 1.10 H new ATOM 0 HE ARG A 84 4.769 6.217 6.147 1.00 1.55 H new ATOM 0 HH11 ARG A 84 4.939 7.676 2.923 1.00 2.53 H new ATOM 0 HH12 ARG A 84 5.697 9.158 3.515 1.00 2.53 H new ATOM 0 HH21 ARG A 84 5.764 8.116 6.879 1.00 2.95 H new ATOM 0 HH22 ARG A 84 6.161 9.406 5.739 1.00 2.95 H new ATOM 1427 N LYS A 85 -0.710 4.993 6.547 1.00 0.21 N ATOM 1428 CA LYS A 85 -1.394 3.851 7.140 1.00 0.22 C ATOM 1429 C LYS A 85 -2.857 4.142 7.433 1.00 0.21 C ATOM 1430 O LYS A 85 -3.185 4.907 8.323 1.00 0.25 O ATOM 1431 CB LYS A 85 -0.688 3.371 8.403 1.00 0.26 C ATOM 1432 CG LYS A 85 0.430 2.378 8.127 1.00 0.46 C ATOM 1433 CD LYS A 85 0.602 1.381 9.265 1.00 1.10 C ATOM 1434 CE LYS A 85 -0.602 0.455 9.411 1.00 1.79 C ATOM 1435 NZ LYS A 85 -0.783 -0.437 8.233 1.00 2.46 N ATOM 0 H LYS A 85 -0.757 5.866 7.073 1.00 0.21 H new ATOM 0 HA LYS A 85 -1.358 3.053 6.398 1.00 0.22 H new ATOM 0 HB2 LYS A 85 -0.278 4.232 8.931 1.00 0.26 H new ATOM 0 HB3 LYS A 85 -1.419 2.909 9.066 1.00 0.26 H new ATOM 0 HG2 LYS A 85 0.217 1.840 7.203 1.00 0.46 H new ATOM 0 HG3 LYS A 85 1.364 2.918 7.974 1.00 0.46 H new ATOM 0 HD2 LYS A 85 1.497 0.784 9.090 1.00 1.10 H new ATOM 0 HD3 LYS A 85 0.757 1.922 10.199 1.00 1.10 H new ATOM 0 HE2 LYS A 85 -0.482 -0.153 10.308 1.00 1.79 H new ATOM 0 HE3 LYS A 85 -1.502 1.054 9.550 1.00 1.79 H new ATOM 0 HZ1 LYS A 85 -1.398 -1.234 8.492 1.00 2.46 H new ATOM 0 HZ2 LYS A 85 -1.219 0.099 7.456 1.00 2.46 H new ATOM 0 HZ3 LYS A 85 0.142 -0.800 7.927 1.00 2.46 H new ATOM 1449 N CYS A 86 -3.728 3.530 6.665 1.00 0.20 N ATOM 1450 CA CYS A 86 -5.154 3.684 6.858 1.00 0.19 C ATOM 1451 C CYS A 86 -5.792 2.306 6.913 1.00 0.18 C ATOM 1452 O CYS A 86 -5.773 1.559 5.943 1.00 0.20 O ATOM 1453 CB CYS A 86 -5.772 4.508 5.724 1.00 0.21 C ATOM 1454 SG CYS A 86 -5.175 6.213 5.639 1.00 0.58 S ATOM 0 H CYS A 86 -3.472 2.915 5.893 1.00 0.20 H new ATOM 0 HA CYS A 86 -5.335 4.215 7.793 1.00 0.19 H new ATOM 0 HB2 CYS A 86 -5.564 4.014 4.775 1.00 0.21 H new ATOM 0 HB3 CYS A 86 -6.855 4.519 5.846 1.00 0.21 H new ATOM 0 HG CYS A 86 -4.166 6.279 4.823 1.00 0.58 H new ATOM 1460 N VAL A 87 -6.368 1.970 8.041 1.00 0.18 N ATOM 1461 CA VAL A 87 -6.993 0.673 8.186 1.00 0.19 C ATOM 1462 C VAL A 87 -8.504 0.827 8.197 1.00 0.17 C ATOM 1463 O VAL A 87 -9.053 1.649 8.925 1.00 0.19 O ATOM 1464 CB VAL A 87 -6.494 -0.076 9.447 1.00 0.26 C ATOM 1465 CG1 VAL A 87 -6.832 0.684 10.723 1.00 0.85 C ATOM 1466 CG2 VAL A 87 -7.056 -1.490 9.488 1.00 0.94 C ATOM 0 H VAL A 87 -6.419 2.568 8.866 1.00 0.18 H new ATOM 0 HA VAL A 87 -6.707 0.062 7.330 1.00 0.19 H new ATOM 0 HB VAL A 87 -5.408 -0.140 9.387 1.00 0.26 H new ATOM 0 HG11 VAL A 87 -6.466 0.127 11.586 1.00 0.85 H new ATOM 0 HG12 VAL A 87 -6.359 1.666 10.698 1.00 0.85 H new ATOM 0 HG13 VAL A 87 -7.913 0.803 10.800 1.00 0.85 H new ATOM 0 HG21 VAL A 87 -6.694 -2.000 10.381 1.00 0.94 H new ATOM 0 HG22 VAL A 87 -8.145 -1.448 9.510 1.00 0.94 H new ATOM 0 HG23 VAL A 87 -6.732 -2.036 8.602 1.00 0.94 H new ATOM 1476 N LEU A 88 -9.172 0.061 7.362 1.00 0.16 N ATOM 1477 CA LEU A 88 -10.617 0.138 7.284 1.00 0.17 C ATOM 1478 C LEU A 88 -11.255 -1.237 7.276 1.00 0.16 C ATOM 1479 O LEU A 88 -10.637 -2.236 6.905 1.00 0.16 O ATOM 1480 CB LEU A 88 -11.067 0.938 6.056 1.00 0.21 C ATOM 1481 CG LEU A 88 -10.692 0.348 4.700 1.00 0.31 C ATOM 1482 CD1 LEU A 88 -11.940 0.138 3.855 1.00 0.58 C ATOM 1483 CD2 LEU A 88 -9.709 1.258 3.977 1.00 0.58 C ATOM 0 H LEU A 88 -8.744 -0.617 6.732 1.00 0.16 H new ATOM 0 HA LEU A 88 -10.954 0.660 8.180 1.00 0.17 H new ATOM 0 HB2 LEU A 88 -12.151 1.047 6.095 1.00 0.21 H new ATOM 0 HB3 LEU A 88 -10.643 1.940 6.124 1.00 0.21 H new ATOM 0 HG LEU A 88 -10.213 -0.618 4.861 1.00 0.31 H new ATOM 0 HD11 LEU A 88 -11.659 -0.283 2.890 1.00 0.58 H new ATOM 0 HD12 LEU A 88 -12.615 -0.547 4.367 1.00 0.58 H new ATOM 0 HD13 LEU A 88 -12.441 1.094 3.702 1.00 0.58 H new ATOM 0 HD21 LEU A 88 -9.452 0.822 3.012 1.00 0.58 H new ATOM 0 HD22 LEU A 88 -10.164 2.237 3.824 1.00 0.58 H new ATOM 0 HD23 LEU A 88 -8.806 1.368 4.577 1.00 0.58 H new ATOM 1495 N PHE A 89 -12.501 -1.270 7.702 1.00 0.17 N ATOM 1496 CA PHE A 89 -13.274 -2.490 7.753 1.00 0.17 C ATOM 1497 C PHE A 89 -14.559 -2.262 6.981 1.00 0.17 C ATOM 1498 O PHE A 89 -15.326 -1.357 7.313 1.00 0.18 O ATOM 1499 CB PHE A 89 -13.579 -2.875 9.206 1.00 0.21 C ATOM 1500 CG PHE A 89 -12.362 -2.894 10.093 1.00 0.39 C ATOM 1501 CD1 PHE A 89 -11.484 -3.966 10.066 1.00 1.20 C ATOM 1502 CD2 PHE A 89 -12.092 -1.834 10.944 1.00 1.33 C ATOM 1503 CE1 PHE A 89 -10.362 -3.981 10.874 1.00 1.29 C ATOM 1504 CE2 PHE A 89 -10.971 -1.843 11.754 1.00 1.48 C ATOM 1505 CZ PHE A 89 -10.104 -2.917 11.718 1.00 0.89 C ATOM 0 H PHE A 89 -13.007 -0.445 8.024 1.00 0.17 H new ATOM 0 HA PHE A 89 -12.710 -3.310 7.309 1.00 0.17 H new ATOM 0 HB2 PHE A 89 -14.305 -2.172 9.615 1.00 0.21 H new ATOM 0 HB3 PHE A 89 -14.045 -3.860 9.222 1.00 0.21 H new ATOM 0 HD1 PHE A 89 -11.678 -4.799 9.407 1.00 1.20 H new ATOM 0 HD2 PHE A 89 -12.765 -0.990 10.975 1.00 1.33 H new ATOM 0 HE1 PHE A 89 -9.687 -4.824 10.846 1.00 1.29 H new ATOM 0 HE2 PHE A 89 -10.774 -1.011 12.414 1.00 1.48 H new ATOM 0 HZ PHE A 89 -9.227 -2.926 12.348 1.00 0.89 H new ATOM 1515 N ILE A 90 -14.784 -3.055 5.949 1.00 0.15 N ATOM 1516 CA ILE A 90 -15.975 -2.898 5.124 1.00 0.16 C ATOM 1517 C ILE A 90 -17.095 -3.793 5.628 1.00 0.16 C ATOM 1518 O ILE A 90 -16.847 -4.894 6.126 1.00 0.19 O ATOM 1519 CB ILE A 90 -15.684 -3.191 3.640 1.00 0.16 C ATOM 1520 CG1 ILE A 90 -15.108 -4.599 3.481 1.00 0.17 C ATOM 1521 CG2 ILE A 90 -14.739 -2.139 3.073 1.00 0.22 C ATOM 1522 CD1 ILE A 90 -14.154 -4.762 2.311 1.00 0.64 C ATOM 0 H ILE A 90 -14.163 -3.811 5.661 1.00 0.15 H new ATOM 0 HA ILE A 90 -16.291 -1.858 5.201 1.00 0.16 H new ATOM 0 HB ILE A 90 -16.617 -3.145 3.078 1.00 0.16 H new ATOM 0 HG12 ILE A 90 -14.586 -4.870 4.399 1.00 0.17 H new ATOM 0 HG13 ILE A 90 -15.931 -5.303 3.363 1.00 0.17 H new ATOM 0 HG21 ILE A 90 -14.540 -2.356 2.023 1.00 0.22 H new ATOM 0 HG22 ILE A 90 -15.197 -1.154 3.159 1.00 0.22 H new ATOM 0 HG23 ILE A 90 -13.802 -2.153 3.630 1.00 0.22 H new ATOM 0 HD11 ILE A 90 -13.795 -5.791 2.275 1.00 0.64 H new ATOM 0 HD12 ILE A 90 -14.674 -4.526 1.382 1.00 0.64 H new ATOM 0 HD13 ILE A 90 -13.308 -4.086 2.435 1.00 0.64 H new ATOM 1534 N GLU A 91 -18.315 -3.305 5.497 1.00 0.14 N ATOM 1535 CA GLU A 91 -19.486 -4.008 5.958 1.00 0.16 C ATOM 1536 C GLU A 91 -20.480 -4.258 4.833 1.00 0.16 C ATOM 1537 O GLU A 91 -21.026 -3.309 4.249 1.00 0.17 O ATOM 1538 CB GLU A 91 -20.160 -3.189 7.048 1.00 0.18 C ATOM 1539 CG GLU A 91 -19.435 -3.221 8.380 1.00 0.31 C ATOM 1540 CD GLU A 91 -20.121 -2.376 9.430 1.00 0.83 C ATOM 1541 OE1 GLU A 91 -21.016 -2.897 10.126 1.00 1.47 O ATOM 1542 OE2 GLU A 91 -19.774 -1.184 9.567 1.00 1.57 O ATOM 0 H GLU A 91 -18.517 -2.404 5.064 1.00 0.14 H new ATOM 0 HA GLU A 91 -19.167 -4.977 6.343 1.00 0.16 H new ATOM 0 HB2 GLU A 91 -20.240 -2.154 6.714 1.00 0.18 H new ATOM 0 HB3 GLU A 91 -21.176 -3.558 7.190 1.00 0.18 H new ATOM 0 HG2 GLU A 91 -19.371 -4.251 8.731 1.00 0.31 H new ATOM 0 HG3 GLU A 91 -18.413 -2.867 8.243 1.00 0.31 H new ATOM 1549 N TRP A 92 -20.713 -5.535 4.544 1.00 0.17 N ATOM 1550 CA TRP A 92 -21.661 -5.932 3.513 1.00 0.19 C ATOM 1551 C TRP A 92 -22.848 -6.605 4.176 1.00 0.21 C ATOM 1552 O TRP A 92 -22.802 -7.802 4.460 1.00 0.22 O ATOM 1553 CB TRP A 92 -21.062 -6.922 2.503 1.00 0.23 C ATOM 1554 CG TRP A 92 -19.606 -6.748 2.200 1.00 0.20 C ATOM 1555 CD1 TRP A 92 -18.558 -7.033 3.025 1.00 0.20 C ATOM 1556 CD2 TRP A 92 -19.039 -6.286 0.972 1.00 0.19 C ATOM 1557 NE1 TRP A 92 -17.371 -6.777 2.385 1.00 0.21 N ATOM 1558 CE2 TRP A 92 -17.641 -6.312 1.123 1.00 0.20 C ATOM 1559 CE3 TRP A 92 -19.578 -5.849 -0.243 1.00 0.22 C ATOM 1560 CZ2 TRP A 92 -16.777 -5.917 0.110 1.00 0.22 C ATOM 1561 CZ3 TRP A 92 -18.716 -5.457 -1.251 1.00 0.25 C ATOM 1562 CH2 TRP A 92 -17.330 -5.495 -1.071 1.00 0.25 C ATOM 0 H TRP A 92 -20.254 -6.315 5.014 1.00 0.17 H new ATOM 0 HA TRP A 92 -21.947 -5.029 2.973 1.00 0.19 H new ATOM 0 HB2 TRP A 92 -21.216 -7.933 2.880 1.00 0.23 H new ATOM 0 HB3 TRP A 92 -21.620 -6.841 1.570 1.00 0.23 H new ATOM 0 HD1 TRP A 92 -18.649 -7.406 4.035 1.00 0.20 H new ATOM 0 HE1 TRP A 92 -16.441 -6.911 2.782 1.00 0.21 H new ATOM 0 HE3 TRP A 92 -20.647 -5.818 -0.391 1.00 0.22 H new ATOM 0 HZ2 TRP A 92 -15.706 -5.941 0.248 1.00 0.22 H new ATOM 0 HZ3 TRP A 92 -19.120 -5.116 -2.193 1.00 0.25 H new ATOM 0 HH2 TRP A 92 -16.683 -5.186 -1.878 1.00 0.25 H new ATOM 1573 N GLU A 93 -23.902 -5.843 4.413 1.00 0.26 N ATOM 1574 CA GLU A 93 -25.106 -6.363 5.050 1.00 0.35 C ATOM 1575 C GLU A 93 -24.762 -7.088 6.358 1.00 0.32 C ATOM 1576 O GLU A 93 -24.965 -8.300 6.483 1.00 0.37 O ATOM 1577 CB GLU A 93 -25.844 -7.305 4.098 1.00 0.46 C ATOM 1578 CG GLU A 93 -27.300 -6.939 3.872 1.00 0.97 C ATOM 1579 CD GLU A 93 -28.199 -8.155 3.821 1.00 1.24 C ATOM 1580 OE1 GLU A 93 -28.163 -8.890 2.811 1.00 1.85 O ATOM 1581 OE2 GLU A 93 -28.938 -8.389 4.800 1.00 1.71 O ATOM 0 H GLU A 93 -23.951 -4.853 4.172 1.00 0.26 H new ATOM 0 HA GLU A 93 -25.758 -5.522 5.288 1.00 0.35 H new ATOM 0 HB2 GLU A 93 -25.328 -7.311 3.138 1.00 0.46 H new ATOM 0 HB3 GLU A 93 -25.792 -8.319 4.494 1.00 0.46 H new ATOM 0 HG2 GLU A 93 -27.634 -6.277 4.671 1.00 0.97 H new ATOM 0 HG3 GLU A 93 -27.392 -6.383 2.939 1.00 0.97 H new ATOM 1588 N LYS A 94 -24.217 -6.326 7.311 1.00 0.30 N ATOM 1589 CA LYS A 94 -23.819 -6.828 8.630 1.00 0.32 C ATOM 1590 C LYS A 94 -22.541 -7.672 8.596 1.00 0.28 C ATOM 1591 O LYS A 94 -22.133 -8.227 9.617 1.00 0.38 O ATOM 1592 CB LYS A 94 -24.957 -7.595 9.299 1.00 0.39 C ATOM 1593 CG LYS A 94 -25.914 -6.689 10.038 1.00 0.54 C ATOM 1594 CD LYS A 94 -25.263 -6.096 11.275 1.00 0.84 C ATOM 1595 CE LYS A 94 -26.299 -5.559 12.239 1.00 1.48 C ATOM 1596 NZ LYS A 94 -25.685 -5.060 13.494 1.00 2.01 N ATOM 0 H LYS A 94 -24.037 -5.330 7.187 1.00 0.30 H new ATOM 0 HA LYS A 94 -23.593 -5.946 9.230 1.00 0.32 H new ATOM 0 HB2 LYS A 94 -25.505 -8.157 8.543 1.00 0.39 H new ATOM 0 HB3 LYS A 94 -24.540 -8.322 9.996 1.00 0.39 H new ATOM 0 HG2 LYS A 94 -26.244 -5.887 9.377 1.00 0.54 H new ATOM 0 HG3 LYS A 94 -26.803 -7.251 10.325 1.00 0.54 H new ATOM 0 HD2 LYS A 94 -24.661 -6.857 11.772 1.00 0.84 H new ATOM 0 HD3 LYS A 94 -24.585 -5.294 10.983 1.00 0.84 H new ATOM 0 HE2 LYS A 94 -26.855 -4.752 11.761 1.00 1.48 H new ATOM 0 HE3 LYS A 94 -27.017 -6.345 12.474 1.00 1.48 H new ATOM 0 HZ1 LYS A 94 -26.429 -4.701 14.126 1.00 2.01 H new ATOM 0 HZ2 LYS A 94 -25.176 -5.836 13.964 1.00 2.01 H new ATOM 0 HZ3 LYS A 94 -25.019 -4.293 13.273 1.00 2.01 H new ATOM 1610 N LYS A 95 -21.911 -7.777 7.434 1.00 0.22 N ATOM 1611 CA LYS A 95 -20.659 -8.520 7.318 1.00 0.21 C ATOM 1612 C LYS A 95 -19.505 -7.566 7.562 1.00 0.20 C ATOM 1613 O LYS A 95 -19.705 -6.359 7.574 1.00 0.29 O ATOM 1614 CB LYS A 95 -20.520 -9.160 5.937 1.00 0.24 C ATOM 1615 CG LYS A 95 -20.506 -10.677 5.968 1.00 0.37 C ATOM 1616 CD LYS A 95 -20.425 -11.261 4.569 1.00 0.65 C ATOM 1617 CE LYS A 95 -20.750 -12.746 4.567 1.00 1.18 C ATOM 1618 NZ LYS A 95 -22.166 -13.004 4.945 1.00 1.70 N ATOM 0 H LYS A 95 -22.241 -7.361 6.563 1.00 0.22 H new ATOM 0 HA LYS A 95 -20.653 -9.321 8.057 1.00 0.21 H new ATOM 0 HB2 LYS A 95 -21.344 -8.826 5.306 1.00 0.24 H new ATOM 0 HB3 LYS A 95 -19.599 -8.806 5.473 1.00 0.24 H new ATOM 0 HG2 LYS A 95 -19.656 -11.022 6.557 1.00 0.37 H new ATOM 0 HG3 LYS A 95 -21.406 -11.040 6.464 1.00 0.37 H new ATOM 0 HD2 LYS A 95 -21.118 -10.735 3.913 1.00 0.65 H new ATOM 0 HD3 LYS A 95 -19.424 -11.106 4.166 1.00 0.65 H new ATOM 0 HE2 LYS A 95 -20.558 -13.159 3.577 1.00 1.18 H new ATOM 0 HE3 LYS A 95 -20.089 -13.263 5.262 1.00 1.18 H new ATOM 0 HZ1 LYS A 95 -22.452 -13.943 4.601 1.00 1.70 H new ATOM 0 HZ2 LYS A 95 -22.260 -12.971 5.980 1.00 1.70 H new ATOM 0 HZ3 LYS A 95 -22.777 -12.278 4.519 1.00 1.70 H new ATOM 1632 N THR A 96 -18.309 -8.082 7.772 1.00 0.18 N ATOM 1633 CA THR A 96 -17.159 -7.221 8.000 1.00 0.19 C ATOM 1634 C THR A 96 -15.890 -7.848 7.440 1.00 0.17 C ATOM 1635 O THR A 96 -15.671 -9.054 7.567 1.00 0.24 O ATOM 1636 CB THR A 96 -16.961 -6.914 9.498 1.00 0.26 C ATOM 1637 OG1 THR A 96 -18.235 -6.759 10.140 1.00 0.32 O ATOM 1638 CG2 THR A 96 -16.144 -5.643 9.690 1.00 0.34 C ATOM 0 H THR A 96 -18.107 -9.082 7.790 1.00 0.18 H new ATOM 0 HA THR A 96 -17.359 -6.284 7.480 1.00 0.19 H new ATOM 0 HB THR A 96 -16.422 -7.749 9.945 1.00 0.26 H new ATOM 0 HG1 THR A 96 -18.101 -6.566 11.091 1.00 0.32 H new ATOM 0 HG21 THR A 96 -16.019 -5.449 10.755 1.00 0.34 H new ATOM 0 HG22 THR A 96 -15.165 -5.766 9.226 1.00 0.34 H new ATOM 0 HG23 THR A 96 -16.663 -4.804 9.227 1.00 0.34 H new ATOM 1646 N TYR A 97 -15.074 -7.029 6.799 1.00 0.16 N ATOM 1647 CA TYR A 97 -13.825 -7.486 6.221 1.00 0.16 C ATOM 1648 C TYR A 97 -12.721 -6.474 6.491 1.00 0.15 C ATOM 1649 O TYR A 97 -12.966 -5.266 6.495 1.00 0.16 O ATOM 1650 CB TYR A 97 -14.007 -7.706 4.724 1.00 0.17 C ATOM 1651 CG TYR A 97 -13.072 -8.734 4.127 1.00 0.95 C ATOM 1652 CD1 TYR A 97 -12.592 -9.805 4.875 1.00 1.23 C ATOM 1653 CD2 TYR A 97 -12.664 -8.623 2.807 1.00 1.61 C ATOM 1654 CE1 TYR A 97 -11.734 -10.731 4.323 1.00 2.05 C ATOM 1655 CE2 TYR A 97 -11.804 -9.546 2.247 1.00 2.45 C ATOM 1656 CZ TYR A 97 -11.342 -10.599 3.010 1.00 2.65 C ATOM 1657 OH TYR A 97 -10.487 -11.521 2.459 1.00 3.49 O ATOM 0 H TYR A 97 -15.258 -6.035 6.666 1.00 0.16 H new ATOM 0 HA TYR A 97 -13.536 -8.431 6.681 1.00 0.16 H new ATOM 0 HB2 TYR A 97 -15.035 -8.015 4.537 1.00 0.17 H new ATOM 0 HB3 TYR A 97 -13.861 -6.757 4.209 1.00 0.17 H new ATOM 0 HD1 TYR A 97 -12.897 -9.912 5.905 1.00 1.23 H new ATOM 0 HD2 TYR A 97 -13.025 -7.801 2.207 1.00 1.61 H new ATOM 0 HE1 TYR A 97 -11.371 -11.556 4.917 1.00 2.05 H new ATOM 0 HE2 TYR A 97 -11.494 -9.445 1.217 1.00 2.45 H new ATOM 0 HH TYR A 97 -9.577 -11.159 2.450 1.00 3.49 H new ATOM 1667 N GLN A 98 -11.509 -6.975 6.703 1.00 0.16 N ATOM 1668 CA GLN A 98 -10.367 -6.124 7.014 1.00 0.16 C ATOM 1669 C GLN A 98 -9.590 -5.742 5.759 1.00 0.15 C ATOM 1670 O GLN A 98 -9.018 -6.601 5.072 1.00 0.15 O ATOM 1671 CB GLN A 98 -9.440 -6.823 8.010 1.00 0.20 C ATOM 1672 CG GLN A 98 -10.184 -7.526 9.136 1.00 1.13 C ATOM 1673 CD GLN A 98 -9.318 -7.775 10.353 1.00 1.77 C ATOM 1674 OE1 GLN A 98 -8.433 -6.982 10.678 1.00 2.37 O ATOM 1675 NE2 GLN A 98 -9.571 -8.880 11.039 1.00 2.49 N ATOM 0 H GLN A 98 -11.292 -7.971 6.665 1.00 0.16 H new ATOM 0 HA GLN A 98 -10.752 -5.208 7.461 1.00 0.16 H new ATOM 0 HB2 GLN A 98 -8.829 -7.552 7.477 1.00 0.20 H new ATOM 0 HB3 GLN A 98 -8.758 -6.088 8.438 1.00 0.20 H new ATOM 0 HG2 GLN A 98 -11.045 -6.924 9.427 1.00 1.13 H new ATOM 0 HG3 GLN A 98 -10.570 -8.478 8.770 1.00 1.13 H new ATOM 0 HE21 GLN A 98 -10.313 -9.510 10.735 1.00 2.49 H new ATOM 0 HE22 GLN A 98 -9.023 -9.100 11.871 1.00 2.49 H new ATOM 1684 N LEU A 99 -9.585 -4.449 5.470 1.00 0.15 N ATOM 1685 CA LEU A 99 -8.884 -3.917 4.319 1.00 0.16 C ATOM 1686 C LEU A 99 -7.856 -2.882 4.763 1.00 0.15 C ATOM 1687 O LEU A 99 -8.208 -1.827 5.297 1.00 0.16 O ATOM 1688 CB LEU A 99 -9.885 -3.296 3.338 1.00 0.18 C ATOM 1689 CG LEU A 99 -9.277 -2.500 2.174 1.00 0.43 C ATOM 1690 CD1 LEU A 99 -8.381 -3.384 1.322 1.00 1.11 C ATOM 1691 CD2 LEU A 99 -10.376 -1.886 1.321 1.00 1.09 C ATOM 0 H LEU A 99 -10.067 -3.744 6.028 1.00 0.15 H new ATOM 0 HA LEU A 99 -8.360 -4.729 3.814 1.00 0.16 H new ATOM 0 HB2 LEU A 99 -10.502 -4.094 2.924 1.00 0.18 H new ATOM 0 HB3 LEU A 99 -10.550 -2.636 3.896 1.00 0.18 H new ATOM 0 HG LEU A 99 -8.668 -1.699 2.592 1.00 0.43 H new ATOM 0 HD11 LEU A 99 -7.962 -2.797 0.504 1.00 1.11 H new ATOM 0 HD12 LEU A 99 -7.572 -3.781 1.935 1.00 1.11 H new ATOM 0 HD13 LEU A 99 -8.965 -4.209 0.914 1.00 1.11 H new ATOM 0 HD21 LEU A 99 -9.929 -1.325 0.500 1.00 1.09 H new ATOM 0 HD22 LEU A 99 -11.008 -2.677 0.918 1.00 1.09 H new ATOM 0 HD23 LEU A 99 -10.979 -1.215 1.933 1.00 1.09 H new ATOM 1703 N ASP A 100 -6.590 -3.196 4.557 1.00 0.16 N ATOM 1704 CA ASP A 100 -5.515 -2.293 4.937 1.00 0.17 C ATOM 1705 C ASP A 100 -5.148 -1.409 3.756 1.00 0.17 C ATOM 1706 O ASP A 100 -4.640 -1.887 2.750 1.00 0.19 O ATOM 1707 CB ASP A 100 -4.287 -3.083 5.396 1.00 0.20 C ATOM 1708 CG ASP A 100 -3.739 -2.600 6.723 1.00 0.42 C ATOM 1709 OD1 ASP A 100 -4.262 -3.032 7.772 1.00 1.21 O ATOM 1710 OD2 ASP A 100 -2.776 -1.804 6.729 1.00 1.20 O ATOM 0 H ASP A 100 -6.279 -4.068 4.129 1.00 0.16 H new ATOM 0 HA ASP A 100 -5.856 -1.671 5.764 1.00 0.17 H new ATOM 0 HB2 ASP A 100 -4.550 -4.138 5.479 1.00 0.20 H new ATOM 0 HB3 ASP A 100 -3.508 -3.007 4.637 1.00 0.20 H new ATOM 1715 N LEU A 101 -5.410 -0.124 3.880 1.00 0.18 N ATOM 1716 CA LEU A 101 -5.124 0.818 2.824 1.00 0.21 C ATOM 1717 C LEU A 101 -3.899 1.647 3.173 1.00 0.21 C ATOM 1718 O LEU A 101 -3.741 2.100 4.302 1.00 0.30 O ATOM 1719 CB LEU A 101 -6.333 1.737 2.624 1.00 0.27 C ATOM 1720 CG LEU A 101 -6.186 2.776 1.517 1.00 0.65 C ATOM 1721 CD1 LEU A 101 -6.039 2.085 0.179 1.00 1.21 C ATOM 1722 CD2 LEU A 101 -7.378 3.723 1.506 1.00 1.14 C ATOM 0 H LEU A 101 -5.825 0.293 4.713 1.00 0.18 H new ATOM 0 HA LEU A 101 -4.923 0.271 1.903 1.00 0.21 H new ATOM 0 HB2 LEU A 101 -7.205 1.120 2.407 1.00 0.27 H new ATOM 0 HB3 LEU A 101 -6.534 2.255 3.562 1.00 0.27 H new ATOM 0 HG LEU A 101 -5.290 3.367 1.707 1.00 0.65 H new ATOM 0 HD11 LEU A 101 -5.934 2.833 -0.607 1.00 1.21 H new ATOM 0 HD12 LEU A 101 -5.155 1.448 0.194 1.00 1.21 H new ATOM 0 HD13 LEU A 101 -6.922 1.476 -0.015 1.00 1.21 H new ATOM 0 HD21 LEU A 101 -7.253 4.456 0.709 1.00 1.14 H new ATOM 0 HD22 LEU A 101 -8.293 3.155 1.336 1.00 1.14 H new ATOM 0 HD23 LEU A 101 -7.443 4.237 2.465 1.00 1.14 H new ATOM 1734 N PHE A 102 -3.021 1.824 2.216 1.00 0.16 N ATOM 1735 CA PHE A 102 -1.838 2.623 2.426 1.00 0.17 C ATOM 1736 C PHE A 102 -1.972 3.887 1.617 1.00 0.15 C ATOM 1737 O PHE A 102 -2.306 3.823 0.434 1.00 0.15 O ATOM 1738 CB PHE A 102 -0.579 1.876 1.978 1.00 0.20 C ATOM 1739 CG PHE A 102 0.277 1.351 3.097 1.00 0.27 C ATOM 1740 CD1 PHE A 102 -0.287 0.693 4.177 1.00 1.25 C ATOM 1741 CD2 PHE A 102 1.653 1.518 3.064 1.00 1.22 C ATOM 1742 CE1 PHE A 102 0.503 0.213 5.203 1.00 1.29 C ATOM 1743 CE2 PHE A 102 2.446 1.042 4.087 1.00 1.27 C ATOM 1744 CZ PHE A 102 1.871 0.388 5.159 1.00 0.53 C ATOM 0 H PHE A 102 -3.104 1.424 1.281 1.00 0.16 H new ATOM 0 HA PHE A 102 -1.744 2.844 3.489 1.00 0.17 H new ATOM 0 HB2 PHE A 102 -0.876 1.040 1.344 1.00 0.20 H new ATOM 0 HB3 PHE A 102 0.023 2.545 1.362 1.00 0.20 H new ATOM 0 HD1 PHE A 102 -1.357 0.554 4.217 1.00 1.25 H new ATOM 0 HD2 PHE A 102 2.109 2.027 2.228 1.00 1.22 H new ATOM 0 HE1 PHE A 102 0.050 -0.299 6.039 1.00 1.29 H new ATOM 0 HE2 PHE A 102 3.516 1.181 4.050 1.00 1.27 H new ATOM 0 HZ PHE A 102 2.491 0.014 5.961 1.00 0.53 H new ATOM 1754 N THR A 103 -1.743 5.033 2.225 1.00 0.15 N ATOM 1755 CA THR A 103 -1.814 6.263 1.471 1.00 0.15 C ATOM 1756 C THR A 103 -0.405 6.744 1.305 1.00 0.16 C ATOM 1757 O THR A 103 0.238 7.153 2.257 1.00 0.18 O ATOM 1758 CB THR A 103 -2.638 7.327 2.229 1.00 0.17 C ATOM 1759 OG1 THR A 103 -2.504 7.125 3.648 1.00 0.19 O ATOM 1760 CG2 THR A 103 -4.105 7.257 1.851 1.00 0.21 C ATOM 0 H THR A 103 -1.512 5.137 3.213 1.00 0.15 H new ATOM 0 HA THR A 103 -2.300 6.094 0.510 1.00 0.15 H new ATOM 0 HB THR A 103 -2.255 8.310 1.953 1.00 0.17 H new ATOM 0 HG1 THR A 103 -1.866 7.774 4.012 1.00 0.19 H new ATOM 0 HG21 THR A 103 -4.659 8.018 2.401 1.00 0.21 H new ATOM 0 HG22 THR A 103 -4.214 7.431 0.781 1.00 0.21 H new ATOM 0 HG23 THR A 103 -4.498 6.271 2.100 1.00 0.21 H new ATOM 1768 N ALA A 104 0.038 6.802 0.090 1.00 0.15 N ATOM 1769 CA ALA A 104 1.401 7.190 -0.149 1.00 0.16 C ATOM 1770 C ALA A 104 1.492 8.185 -1.270 1.00 0.16 C ATOM 1771 O ALA A 104 0.501 8.510 -1.890 1.00 0.19 O ATOM 1772 CB ALA A 104 2.232 5.960 -0.462 1.00 0.17 C ATOM 0 H ALA A 104 -0.510 6.590 -0.744 1.00 0.15 H new ATOM 0 HA ALA A 104 1.790 7.668 0.750 1.00 0.16 H new ATOM 0 HB1 ALA A 104 3.265 6.256 -0.643 1.00 0.17 H new ATOM 0 HB2 ALA A 104 2.194 5.271 0.382 1.00 0.17 H new ATOM 0 HB3 ALA A 104 1.834 5.469 -1.350 1.00 0.17 H new ATOM 1778 N LEU A 105 2.681 8.672 -1.504 1.00 0.16 N ATOM 1779 CA LEU A 105 2.909 9.616 -2.560 1.00 0.17 C ATOM 1780 C LEU A 105 3.049 8.842 -3.840 1.00 0.17 C ATOM 1781 O LEU A 105 3.311 7.641 -3.807 1.00 0.16 O ATOM 1782 CB LEU A 105 4.188 10.426 -2.289 1.00 0.20 C ATOM 1783 CG LEU A 105 4.007 11.928 -2.037 1.00 0.28 C ATOM 1784 CD1 LEU A 105 3.712 12.658 -3.334 1.00 0.66 C ATOM 1785 CD2 LEU A 105 2.906 12.177 -1.018 1.00 0.85 C ATOM 0 H LEU A 105 3.514 8.426 -0.970 1.00 0.16 H new ATOM 0 HA LEU A 105 2.078 10.318 -2.625 1.00 0.17 H new ATOM 0 HB2 LEU A 105 4.689 9.993 -1.423 1.00 0.20 H new ATOM 0 HB3 LEU A 105 4.857 10.301 -3.140 1.00 0.20 H new ATOM 0 HG LEU A 105 4.940 12.318 -1.630 1.00 0.28 H new ATOM 0 HD11 LEU A 105 3.587 13.722 -3.132 1.00 0.66 H new ATOM 0 HD12 LEU A 105 4.540 12.515 -4.028 1.00 0.66 H new ATOM 0 HD13 LEU A 105 2.797 12.262 -3.774 1.00 0.66 H new ATOM 0 HD21 LEU A 105 2.796 13.249 -0.856 1.00 0.85 H new ATOM 0 HD22 LEU A 105 1.967 11.768 -1.390 1.00 0.85 H new ATOM 0 HD23 LEU A 105 3.165 11.692 -0.077 1.00 0.85 H new ATOM 1797 N ALA A 106 2.853 9.503 -4.961 1.00 0.19 N ATOM 1798 CA ALA A 106 3.011 8.842 -6.241 1.00 0.22 C ATOM 1799 C ALA A 106 4.432 8.307 -6.356 1.00 0.24 C ATOM 1800 O ALA A 106 4.712 7.382 -7.117 1.00 0.27 O ATOM 1801 CB ALA A 106 2.691 9.798 -7.378 1.00 0.26 C ATOM 0 H ALA A 106 2.587 10.486 -5.014 1.00 0.19 H new ATOM 0 HA ALA A 106 2.313 8.007 -6.309 1.00 0.22 H new ATOM 0 HB1 ALA A 106 2.815 9.284 -8.331 1.00 0.26 H new ATOM 0 HB2 ALA A 106 1.662 10.144 -7.284 1.00 0.26 H new ATOM 0 HB3 ALA A 106 3.366 10.653 -7.336 1.00 0.26 H new ATOM 1807 N GLU A 107 5.315 8.894 -5.559 1.00 0.25 N ATOM 1808 CA GLU A 107 6.708 8.517 -5.527 1.00 0.30 C ATOM 1809 C GLU A 107 6.912 7.311 -4.612 1.00 0.26 C ATOM 1810 O GLU A 107 7.803 6.496 -4.833 1.00 0.28 O ATOM 1811 CB GLU A 107 7.549 9.697 -5.033 1.00 0.38 C ATOM 1812 CG GLU A 107 6.966 11.067 -5.365 1.00 1.06 C ATOM 1813 CD GLU A 107 6.912 11.351 -6.853 1.00 1.19 C ATOM 1814 OE1 GLU A 107 7.975 11.618 -7.448 1.00 1.81 O ATOM 1815 OE2 GLU A 107 5.805 11.333 -7.431 1.00 1.85 O ATOM 0 H GLU A 107 5.076 9.649 -4.916 1.00 0.25 H new ATOM 0 HA GLU A 107 7.024 8.246 -6.534 1.00 0.30 H new ATOM 0 HB2 GLU A 107 7.666 9.617 -3.952 1.00 0.38 H new ATOM 0 HB3 GLU A 107 8.546 9.624 -5.468 1.00 0.38 H new ATOM 0 HG2 GLU A 107 5.959 11.136 -4.952 1.00 1.06 H new ATOM 0 HG3 GLU A 107 7.564 11.837 -4.877 1.00 1.06 H new ATOM 1822 N GLU A 108 6.062 7.199 -3.591 1.00 0.23 N ATOM 1823 CA GLU A 108 6.154 6.115 -2.620 1.00 0.23 C ATOM 1824 C GLU A 108 5.389 4.876 -3.082 1.00 0.19 C ATOM 1825 O GLU A 108 5.105 3.981 -2.290 1.00 0.21 O ATOM 1826 CB GLU A 108 5.611 6.575 -1.270 1.00 0.27 C ATOM 1827 CG GLU A 108 6.457 7.637 -0.590 1.00 0.50 C ATOM 1828 CD GLU A 108 5.791 8.191 0.656 1.00 1.51 C ATOM 1829 OE1 GLU A 108 4.846 7.554 1.166 1.00 2.25 O ATOM 1830 OE2 GLU A 108 6.211 9.271 1.127 1.00 2.23 O ATOM 0 H GLU A 108 5.298 7.852 -3.417 1.00 0.23 H new ATOM 0 HA GLU A 108 7.206 5.848 -2.524 1.00 0.23 H new ATOM 0 HB2 GLU A 108 4.602 6.964 -1.410 1.00 0.27 H new ATOM 0 HB3 GLU A 108 5.531 5.712 -0.609 1.00 0.27 H new ATOM 0 HG2 GLU A 108 7.425 7.212 -0.324 1.00 0.50 H new ATOM 0 HG3 GLU A 108 6.647 8.450 -1.290 1.00 0.50 H new ATOM 1837 N LYS A 109 5.096 4.822 -4.368 1.00 0.18 N ATOM 1838 CA LYS A 109 4.349 3.710 -4.955 1.00 0.18 C ATOM 1839 C LYS A 109 5.079 2.356 -4.821 1.00 0.18 C ATOM 1840 O LYS A 109 4.474 1.383 -4.374 1.00 0.20 O ATOM 1841 CB LYS A 109 4.029 4.027 -6.424 1.00 0.22 C ATOM 1842 CG LYS A 109 3.828 2.804 -7.313 1.00 0.42 C ATOM 1843 CD LYS A 109 2.488 2.123 -7.064 1.00 0.85 C ATOM 1844 CE LYS A 109 1.318 2.997 -7.493 1.00 1.21 C ATOM 1845 NZ LYS A 109 1.481 3.516 -8.878 1.00 1.51 N ATOM 0 H LYS A 109 5.365 5.542 -5.038 1.00 0.18 H new ATOM 0 HA LYS A 109 3.420 3.603 -4.394 1.00 0.18 H new ATOM 0 HB2 LYS A 109 3.127 4.638 -6.461 1.00 0.22 H new ATOM 0 HB3 LYS A 109 4.839 4.629 -6.836 1.00 0.22 H new ATOM 0 HG2 LYS A 109 3.892 3.103 -8.359 1.00 0.42 H new ATOM 0 HG3 LYS A 109 4.634 2.092 -7.135 1.00 0.42 H new ATOM 0 HD2 LYS A 109 2.454 1.179 -7.608 1.00 0.85 H new ATOM 0 HD3 LYS A 109 2.393 1.884 -6.005 1.00 0.85 H new ATOM 0 HE2 LYS A 109 0.394 2.422 -7.429 1.00 1.21 H new ATOM 0 HE3 LYS A 109 1.220 3.835 -6.802 1.00 1.21 H new ATOM 0 HZ1 LYS A 109 0.546 3.631 -9.318 1.00 1.51 H new ATOM 0 HZ2 LYS A 109 1.966 4.436 -8.849 1.00 1.51 H new ATOM 0 HZ3 LYS A 109 2.045 2.844 -9.436 1.00 1.51 H new ATOM 1859 N PRO A 110 6.380 2.255 -5.179 1.00 0.16 N ATOM 1860 CA PRO A 110 7.103 0.988 -5.082 1.00 0.17 C ATOM 1861 C PRO A 110 7.252 0.532 -3.637 1.00 0.15 C ATOM 1862 O PRO A 110 6.848 -0.575 -3.285 1.00 0.17 O ATOM 1863 CB PRO A 110 8.464 1.286 -5.718 1.00 0.19 C ATOM 1864 CG PRO A 110 8.626 2.765 -5.625 1.00 0.18 C ATOM 1865 CD PRO A 110 7.239 3.346 -5.668 1.00 0.17 C ATOM 0 HA PRO A 110 6.577 0.174 -5.581 1.00 0.17 H new ATOM 0 HB2 PRO A 110 9.266 0.769 -5.192 1.00 0.19 H new ATOM 0 HB3 PRO A 110 8.495 0.951 -6.755 1.00 0.19 H new ATOM 0 HG2 PRO A 110 9.135 3.043 -4.702 1.00 0.18 H new ATOM 0 HG3 PRO A 110 9.231 3.142 -6.449 1.00 0.18 H new ATOM 0 HD2 PRO A 110 7.157 4.231 -5.037 1.00 0.17 H new ATOM 0 HD3 PRO A 110 6.964 3.648 -6.679 1.00 0.17 H new ATOM 1873 N TYR A 111 7.852 1.387 -2.816 1.00 0.14 N ATOM 1874 CA TYR A 111 8.028 1.123 -1.385 1.00 0.14 C ATOM 1875 C TYR A 111 6.737 0.657 -0.736 1.00 0.15 C ATOM 1876 O TYR A 111 6.751 -0.185 0.157 1.00 0.17 O ATOM 1877 CB TYR A 111 8.468 2.398 -0.672 1.00 0.17 C ATOM 1878 CG TYR A 111 9.884 2.391 -0.162 1.00 0.21 C ATOM 1879 CD1 TYR A 111 10.940 2.132 -1.011 1.00 0.41 C ATOM 1880 CD2 TYR A 111 10.163 2.668 1.170 1.00 0.49 C ATOM 1881 CE1 TYR A 111 12.242 2.154 -0.556 1.00 0.44 C ATOM 1882 CE2 TYR A 111 11.465 2.699 1.631 1.00 0.56 C ATOM 1883 CZ TYR A 111 12.496 2.436 0.762 1.00 0.39 C ATOM 1884 OH TYR A 111 13.791 2.476 1.202 1.00 0.49 O ATOM 0 H TYR A 111 8.231 2.284 -3.120 1.00 0.14 H new ATOM 0 HA TYR A 111 8.781 0.340 -1.295 1.00 0.14 H new ATOM 0 HB2 TYR A 111 8.350 3.238 -1.357 1.00 0.17 H new ATOM 0 HB3 TYR A 111 7.797 2.575 0.168 1.00 0.17 H new ATOM 0 HD1 TYR A 111 10.744 1.908 -2.049 1.00 0.41 H new ATOM 0 HD2 TYR A 111 9.351 2.862 1.855 1.00 0.49 H new ATOM 0 HE1 TYR A 111 13.057 1.950 -1.234 1.00 0.44 H new ATOM 0 HE2 TYR A 111 11.671 2.928 2.666 1.00 0.56 H new ATOM 0 HH TYR A 111 14.089 3.408 1.257 1.00 0.49 H new ATOM 1894 N ALA A 112 5.632 1.214 -1.191 1.00 0.15 N ATOM 1895 CA ALA A 112 4.327 0.871 -0.639 1.00 0.18 C ATOM 1896 C ALA A 112 4.016 -0.600 -0.849 1.00 0.19 C ATOM 1897 O ALA A 112 3.615 -1.305 0.083 1.00 0.22 O ATOM 1898 CB ALA A 112 3.252 1.738 -1.255 1.00 0.19 C ATOM 0 H ALA A 112 5.607 1.906 -1.940 1.00 0.15 H new ATOM 0 HA ALA A 112 4.351 1.057 0.435 1.00 0.18 H new ATOM 0 HB1 ALA A 112 2.283 1.471 -0.833 1.00 0.19 H new ATOM 0 HB2 ALA A 112 3.464 2.786 -1.042 1.00 0.19 H new ATOM 0 HB3 ALA A 112 3.233 1.583 -2.334 1.00 0.19 H new ATOM 1904 N ILE A 113 4.225 -1.064 -2.071 1.00 0.19 N ATOM 1905 CA ILE A 113 3.979 -2.452 -2.398 1.00 0.23 C ATOM 1906 C ILE A 113 5.000 -3.324 -1.684 1.00 0.22 C ATOM 1907 O ILE A 113 4.652 -4.374 -1.162 1.00 0.24 O ATOM 1908 CB ILE A 113 4.023 -2.698 -3.932 1.00 0.26 C ATOM 1909 CG1 ILE A 113 2.659 -2.393 -4.564 1.00 0.28 C ATOM 1910 CG2 ILE A 113 4.433 -4.131 -4.255 1.00 0.38 C ATOM 1911 CD1 ILE A 113 2.286 -0.928 -4.567 1.00 0.28 C ATOM 0 H ILE A 113 4.564 -0.498 -2.849 1.00 0.19 H new ATOM 0 HA ILE A 113 2.976 -2.714 -2.062 1.00 0.23 H new ATOM 0 HB ILE A 113 4.772 -2.026 -4.351 1.00 0.26 H new ATOM 0 HG12 ILE A 113 2.658 -2.758 -5.591 1.00 0.28 H new ATOM 0 HG13 ILE A 113 1.891 -2.950 -4.028 1.00 0.28 H new ATOM 0 HG21 ILE A 113 4.454 -4.269 -5.336 1.00 0.38 H new ATOM 0 HG22 ILE A 113 5.424 -4.327 -3.845 1.00 0.38 H new ATOM 0 HG23 ILE A 113 3.715 -4.823 -3.815 1.00 0.38 H new ATOM 0 HD11 ILE A 113 1.308 -0.803 -5.032 1.00 0.28 H new ATOM 0 HD12 ILE A 113 2.251 -0.559 -3.542 1.00 0.28 H new ATOM 0 HD13 ILE A 113 3.030 -0.364 -5.130 1.00 0.28 H new ATOM 1923 N PHE A 114 6.234 -2.828 -1.601 1.00 0.19 N ATOM 1924 CA PHE A 114 7.327 -3.548 -0.958 1.00 0.19 C ATOM 1925 C PHE A 114 7.041 -3.788 0.521 1.00 0.20 C ATOM 1926 O PHE A 114 7.259 -4.879 1.043 1.00 0.23 O ATOM 1927 CB PHE A 114 8.617 -2.742 -1.116 1.00 0.17 C ATOM 1928 CG PHE A 114 9.882 -3.541 -0.943 1.00 0.16 C ATOM 1929 CD1 PHE A 114 9.936 -4.890 -1.272 1.00 0.22 C ATOM 1930 CD2 PHE A 114 11.025 -2.934 -0.447 1.00 0.20 C ATOM 1931 CE1 PHE A 114 11.105 -5.610 -1.108 1.00 0.24 C ATOM 1932 CE2 PHE A 114 12.194 -3.650 -0.283 1.00 0.20 C ATOM 1933 CZ PHE A 114 12.234 -4.990 -0.615 1.00 0.18 C ATOM 0 H PHE A 114 6.501 -1.918 -1.977 1.00 0.19 H new ATOM 0 HA PHE A 114 7.432 -4.521 -1.437 1.00 0.19 H new ATOM 0 HB2 PHE A 114 8.625 -2.284 -2.105 1.00 0.17 H new ATOM 0 HB3 PHE A 114 8.614 -1.930 -0.389 1.00 0.17 H new ATOM 0 HD1 PHE A 114 9.056 -5.381 -1.660 1.00 0.22 H new ATOM 0 HD2 PHE A 114 11.001 -1.886 -0.185 1.00 0.20 H new ATOM 0 HE1 PHE A 114 11.134 -6.658 -1.366 1.00 0.24 H new ATOM 0 HE2 PHE A 114 13.076 -3.163 0.105 1.00 0.20 H new ATOM 0 HZ PHE A 114 13.148 -5.551 -0.489 1.00 0.18 H new ATOM 1943 N HIS A 115 6.554 -2.753 1.188 1.00 0.20 N ATOM 1944 CA HIS A 115 6.222 -2.830 2.603 1.00 0.22 C ATOM 1945 C HIS A 115 4.997 -3.721 2.806 1.00 0.25 C ATOM 1946 O HIS A 115 4.862 -4.401 3.824 1.00 0.29 O ATOM 1947 CB HIS A 115 5.962 -1.425 3.156 1.00 0.24 C ATOM 1948 CG HIS A 115 6.001 -1.339 4.652 1.00 0.48 C ATOM 1949 ND1 HIS A 115 7.171 -1.084 5.328 1.00 1.26 N ATOM 1950 CD2 HIS A 115 4.994 -1.473 5.548 1.00 0.74 C ATOM 1951 CE1 HIS A 115 6.851 -1.071 6.609 1.00 1.37 C ATOM 1952 NE2 HIS A 115 5.545 -1.302 6.792 1.00 0.94 N ATOM 0 H HIS A 115 6.378 -1.841 0.767 1.00 0.20 H new ATOM 0 HA HIS A 115 7.062 -3.267 3.144 1.00 0.22 H new ATOM 0 HB2 HIS A 115 6.704 -0.741 2.744 1.00 0.24 H new ATOM 0 HB3 HIS A 115 4.987 -1.084 2.809 1.00 0.24 H new ATOM 0 HD2 HIS A 115 3.957 -1.676 5.325 1.00 0.74 H new ATOM 0 HE1 HIS A 115 7.555 -0.896 7.409 1.00 1.37 H new ATOM 0 HE2 HIS A 115 5.054 -1.343 7.685 1.00 0.94 H new ATOM 1960 N PHE A 116 4.073 -3.661 1.859 1.00 0.25 N ATOM 1961 CA PHE A 116 2.866 -4.469 1.930 1.00 0.30 C ATOM 1962 C PHE A 116 3.160 -5.953 1.702 1.00 0.34 C ATOM 1963 O PHE A 116 2.673 -6.808 2.450 1.00 0.40 O ATOM 1964 CB PHE A 116 1.841 -3.973 0.920 1.00 0.29 C ATOM 1965 CG PHE A 116 0.683 -3.254 1.546 1.00 0.29 C ATOM 1966 CD1 PHE A 116 0.206 -3.618 2.797 1.00 1.12 C ATOM 1967 CD2 PHE A 116 0.070 -2.212 0.880 1.00 1.06 C ATOM 1968 CE1 PHE A 116 -0.860 -2.952 3.366 1.00 1.15 C ATOM 1969 CE2 PHE A 116 -0.996 -1.546 1.443 1.00 1.07 C ATOM 1970 CZ PHE A 116 -1.463 -1.916 2.687 1.00 0.41 C ATOM 0 H PHE A 116 4.136 -3.063 1.035 1.00 0.25 H new ATOM 0 HA PHE A 116 2.459 -4.366 2.936 1.00 0.30 H new ATOM 0 HB2 PHE A 116 2.333 -3.306 0.213 1.00 0.29 H new ATOM 0 HB3 PHE A 116 1.465 -4.822 0.349 1.00 0.29 H new ATOM 0 HD1 PHE A 116 0.674 -4.432 3.331 1.00 1.12 H new ATOM 0 HD2 PHE A 116 0.430 -1.915 -0.094 1.00 1.06 H new ATOM 0 HE1 PHE A 116 -1.221 -3.242 4.342 1.00 1.15 H new ATOM 0 HE2 PHE A 116 -1.467 -0.733 0.910 1.00 1.07 H new ATOM 0 HZ PHE A 116 -2.300 -1.395 3.128 1.00 0.41 H new ATOM 1980 N THR A 117 3.919 -6.268 0.654 1.00 0.33 N ATOM 1981 CA THR A 117 4.281 -7.648 0.368 1.00 0.39 C ATOM 1982 C THR A 117 5.147 -8.198 1.495 1.00 0.31 C ATOM 1983 O THR A 117 4.841 -9.230 2.086 1.00 0.27 O ATOM 1984 CB THR A 117 5.068 -7.775 -0.944 1.00 0.50 C ATOM 1985 OG1 THR A 117 5.950 -6.659 -1.096 1.00 0.89 O ATOM 1986 CG2 THR A 117 4.130 -7.871 -2.135 1.00 0.84 C ATOM 0 H THR A 117 4.292 -5.587 -0.007 1.00 0.33 H new ATOM 0 HA THR A 117 3.352 -8.211 0.277 1.00 0.39 H new ATOM 0 HB THR A 117 5.657 -8.691 -0.903 1.00 0.50 H new ATOM 0 HG1 THR A 117 6.404 -6.716 -1.963 1.00 0.89 H new ATOM 0 HG21 THR A 117 4.713 -7.960 -3.051 1.00 0.84 H new ATOM 0 HG22 THR A 117 3.491 -8.747 -2.025 1.00 0.84 H new ATOM 0 HG23 THR A 117 3.512 -6.975 -2.184 1.00 0.84 H new ATOM 1994 N GLY A 118 6.215 -7.470 1.795 1.00 0.34 N ATOM 1995 CA GLY A 118 7.136 -7.845 2.843 1.00 0.29 C ATOM 1996 C GLY A 118 6.765 -7.155 4.108 1.00 0.29 C ATOM 1997 O GLY A 118 7.031 -5.966 4.256 1.00 0.35 O ATOM 0 H GLY A 118 6.461 -6.604 1.315 1.00 0.34 H new ATOM 0 HA2 GLY A 118 7.117 -8.925 2.988 1.00 0.29 H new ATOM 0 HA3 GLY A 118 8.154 -7.580 2.558 1.00 0.29 H new ATOM 2001 N PRO A 119 6.161 -7.883 5.048 1.00 0.29 N ATOM 2002 CA PRO A 119 5.690 -7.315 6.292 1.00 0.34 C ATOM 2003 C PRO A 119 6.681 -6.418 6.959 1.00 0.34 C ATOM 2004 O PRO A 119 6.361 -5.292 7.354 1.00 0.43 O ATOM 2005 CB PRO A 119 5.367 -8.531 7.155 1.00 0.37 C ATOM 2006 CG PRO A 119 5.027 -9.593 6.171 1.00 0.44 C ATOM 2007 CD PRO A 119 5.892 -9.327 4.969 1.00 0.32 C ATOM 0 HA PRO A 119 4.832 -6.664 6.124 1.00 0.34 H new ATOM 0 HB2 PRO A 119 6.217 -8.818 7.774 1.00 0.37 H new ATOM 0 HB3 PRO A 119 4.535 -8.331 7.830 1.00 0.37 H new ATOM 0 HG2 PRO A 119 5.221 -10.584 6.582 1.00 0.44 H new ATOM 0 HG3 PRO A 119 3.970 -9.559 5.908 1.00 0.44 H new ATOM 0 HD2 PRO A 119 6.813 -9.909 5.002 1.00 0.32 H new ATOM 0 HD3 PRO A 119 5.382 -9.590 4.042 1.00 0.32 H new ATOM 2015 N VAL A 120 7.870 -6.922 7.069 1.00 0.27 N ATOM 2016 CA VAL A 120 8.945 -6.171 7.665 1.00 0.27 C ATOM 2017 C VAL A 120 10.216 -6.995 7.787 1.00 0.25 C ATOM 2018 O VAL A 120 11.303 -6.454 7.677 1.00 0.24 O ATOM 2019 CB VAL A 120 8.563 -5.602 9.058 1.00 0.34 C ATOM 2020 CG1 VAL A 120 8.446 -6.708 10.101 1.00 0.39 C ATOM 2021 CG2 VAL A 120 9.559 -4.540 9.501 1.00 0.35 C ATOM 0 H VAL A 120 8.128 -7.857 6.753 1.00 0.27 H new ATOM 0 HA VAL A 120 9.132 -5.336 6.990 1.00 0.27 H new ATOM 0 HB VAL A 120 7.583 -5.133 8.965 1.00 0.34 H new ATOM 0 HG11 VAL A 120 8.177 -6.273 11.064 1.00 0.39 H new ATOM 0 HG12 VAL A 120 7.676 -7.416 9.795 1.00 0.39 H new ATOM 0 HG13 VAL A 120 9.401 -7.226 10.191 1.00 0.39 H new ATOM 0 HG21 VAL A 120 9.270 -4.156 10.480 1.00 0.35 H new ATOM 0 HG22 VAL A 120 10.555 -4.978 9.562 1.00 0.35 H new ATOM 0 HG23 VAL A 120 9.566 -3.724 8.779 1.00 0.35 H new ATOM 2031 N SER A 121 10.080 -8.301 7.969 1.00 0.28 N ATOM 2032 CA SER A 121 11.244 -9.173 8.149 1.00 0.31 C ATOM 2033 C SER A 121 12.249 -9.028 7.006 1.00 0.27 C ATOM 2034 O SER A 121 13.453 -8.860 7.246 1.00 0.28 O ATOM 2035 CB SER A 121 10.801 -10.626 8.298 1.00 0.36 C ATOM 2036 OG SER A 121 9.770 -10.739 9.266 1.00 0.49 O ATOM 0 H SER A 121 9.182 -8.783 7.997 1.00 0.28 H new ATOM 0 HA SER A 121 11.750 -8.863 9.064 1.00 0.31 H new ATOM 0 HB2 SER A 121 10.449 -11.004 7.338 1.00 0.36 H new ATOM 0 HB3 SER A 121 11.651 -11.242 8.591 1.00 0.36 H new ATOM 0 HG SER A 121 9.498 -11.677 9.346 1.00 0.49 H new ATOM 2042 N TYR A 122 11.765 -9.085 5.772 1.00 0.25 N ATOM 2043 CA TYR A 122 12.640 -8.929 4.613 1.00 0.26 C ATOM 2044 C TYR A 122 13.262 -7.539 4.622 1.00 0.22 C ATOM 2045 O TYR A 122 14.415 -7.352 4.237 1.00 0.23 O ATOM 2046 CB TYR A 122 11.851 -9.144 3.319 1.00 0.28 C ATOM 2047 CG TYR A 122 12.692 -9.456 2.100 1.00 0.29 C ATOM 2048 CD1 TYR A 122 13.860 -10.202 2.196 1.00 0.39 C ATOM 2049 CD2 TYR A 122 12.306 -9.005 0.844 1.00 0.33 C ATOM 2050 CE1 TYR A 122 14.620 -10.486 1.078 1.00 0.43 C ATOM 2051 CE2 TYR A 122 13.060 -9.288 -0.280 1.00 0.34 C ATOM 2052 CZ TYR A 122 14.216 -10.028 -0.155 1.00 0.35 C ATOM 2053 OH TYR A 122 14.970 -10.319 -1.270 1.00 0.41 O ATOM 0 H TYR A 122 10.782 -9.236 5.547 1.00 0.25 H new ATOM 0 HA TYR A 122 13.432 -9.676 4.665 1.00 0.26 H new ATOM 0 HB2 TYR A 122 11.145 -9.960 3.473 1.00 0.28 H new ATOM 0 HB3 TYR A 122 11.263 -8.248 3.117 1.00 0.28 H new ATOM 0 HD1 TYR A 122 14.179 -10.566 3.161 1.00 0.39 H new ATOM 0 HD2 TYR A 122 11.402 -8.423 0.744 1.00 0.33 H new ATOM 0 HE1 TYR A 122 15.527 -11.065 1.171 1.00 0.43 H new ATOM 0 HE2 TYR A 122 12.745 -8.931 -1.250 1.00 0.34 H new ATOM 0 HH TYR A 122 15.129 -9.498 -1.781 1.00 0.41 H new ATOM 2063 N LEU A 123 12.507 -6.582 5.132 1.00 0.19 N ATOM 2064 CA LEU A 123 12.955 -5.203 5.195 1.00 0.19 C ATOM 2065 C LEU A 123 13.987 -5.036 6.305 1.00 0.19 C ATOM 2066 O LEU A 123 14.877 -4.196 6.209 1.00 0.19 O ATOM 2067 CB LEU A 123 11.755 -4.268 5.393 1.00 0.21 C ATOM 2068 CG LEU A 123 11.034 -3.834 4.110 1.00 0.24 C ATOM 2069 CD1 LEU A 123 11.496 -4.640 2.903 1.00 0.31 C ATOM 2070 CD2 LEU A 123 9.530 -3.969 4.280 1.00 0.29 C ATOM 0 H LEU A 123 11.573 -6.737 5.511 1.00 0.19 H new ATOM 0 HA LEU A 123 13.434 -4.935 4.253 1.00 0.19 H new ATOM 0 HB2 LEU A 123 11.034 -4.764 6.043 1.00 0.21 H new ATOM 0 HB3 LEU A 123 12.096 -3.375 5.917 1.00 0.21 H new ATOM 0 HG LEU A 123 11.285 -2.789 3.929 1.00 0.24 H new ATOM 0 HD11 LEU A 123 10.962 -4.303 2.014 1.00 0.31 H new ATOM 0 HD12 LEU A 123 12.567 -4.498 2.759 1.00 0.31 H new ATOM 0 HD13 LEU A 123 11.290 -5.697 3.071 1.00 0.31 H new ATOM 0 HD21 LEU A 123 9.031 -3.658 3.362 1.00 0.29 H new ATOM 0 HD22 LEU A 123 9.280 -5.008 4.495 1.00 0.29 H new ATOM 0 HD23 LEU A 123 9.199 -3.338 5.105 1.00 0.29 H new ATOM 2082 N ILE A 124 13.870 -5.852 7.349 1.00 0.21 N ATOM 2083 CA ILE A 124 14.809 -5.810 8.464 1.00 0.23 C ATOM 2084 C ILE A 124 16.159 -6.336 8.014 1.00 0.23 C ATOM 2085 O ILE A 124 17.194 -5.709 8.245 1.00 0.24 O ATOM 2086 CB ILE A 124 14.356 -6.660 9.678 1.00 0.28 C ATOM 2087 CG1 ILE A 124 12.903 -6.362 10.054 1.00 0.30 C ATOM 2088 CG2 ILE A 124 15.279 -6.413 10.865 1.00 0.32 C ATOM 2089 CD1 ILE A 124 12.500 -6.873 11.424 1.00 0.38 C ATOM 0 H ILE A 124 13.133 -6.551 7.445 1.00 0.21 H new ATOM 0 HA ILE A 124 14.861 -4.767 8.777 1.00 0.23 H new ATOM 0 HB ILE A 124 14.416 -7.712 9.398 1.00 0.28 H new ATOM 0 HG12 ILE A 124 12.744 -5.284 10.019 1.00 0.30 H new ATOM 0 HG13 ILE A 124 12.247 -6.806 9.305 1.00 0.30 H new ATOM 0 HG21 ILE A 124 14.951 -7.015 11.712 1.00 0.32 H new ATOM 0 HG22 ILE A 124 16.299 -6.689 10.597 1.00 0.32 H new ATOM 0 HG23 ILE A 124 15.248 -5.358 11.136 1.00 0.32 H new ATOM 0 HD11 ILE A 124 11.457 -6.621 11.614 1.00 0.38 H new ATOM 0 HD12 ILE A 124 12.625 -7.955 11.460 1.00 0.38 H new ATOM 0 HD13 ILE A 124 13.129 -6.410 12.184 1.00 0.38 H new ATOM 2101 N ARG A 125 16.133 -7.479 7.337 1.00 0.24 N ATOM 2102 CA ARG A 125 17.358 -8.105 6.863 1.00 0.26 C ATOM 2103 C ARG A 125 18.007 -7.251 5.790 1.00 0.24 C ATOM 2104 O ARG A 125 19.227 -7.151 5.729 1.00 0.26 O ATOM 2105 CB ARG A 125 17.086 -9.525 6.349 1.00 0.31 C ATOM 2106 CG ARG A 125 16.548 -9.591 4.930 1.00 1.06 C ATOM 2107 CD ARG A 125 17.144 -10.759 4.172 1.00 2.18 C ATOM 2108 NE ARG A 125 16.185 -11.849 4.001 1.00 2.73 N ATOM 2109 CZ ARG A 125 16.360 -12.863 3.158 1.00 3.68 C ATOM 2110 NH1 ARG A 125 17.458 -12.933 2.419 1.00 4.16 N ATOM 2111 NH2 ARG A 125 15.430 -13.803 3.047 1.00 4.42 N ATOM 0 H ARG A 125 15.280 -7.988 7.106 1.00 0.24 H new ATOM 0 HA ARG A 125 18.050 -8.184 7.701 1.00 0.26 H new ATOM 0 HB2 ARG A 125 18.011 -10.099 6.400 1.00 0.31 H new ATOM 0 HB3 ARG A 125 16.373 -10.009 7.017 1.00 0.31 H new ATOM 0 HG2 ARG A 125 15.462 -9.686 4.954 1.00 1.06 H new ATOM 0 HG3 ARG A 125 16.776 -8.661 4.408 1.00 1.06 H new ATOM 0 HD2 ARG A 125 17.485 -10.420 3.194 1.00 2.18 H new ATOM 0 HD3 ARG A 125 18.020 -11.128 4.705 1.00 2.18 H new ATOM 0 HE ARG A 125 15.332 -11.831 4.560 1.00 2.73 H new ATOM 0 HH11 ARG A 125 18.172 -12.208 2.496 1.00 4.16 H new ATOM 0 HH12 ARG A 125 17.589 -13.712 1.773 1.00 4.16 H new ATOM 0 HH21 ARG A 125 14.580 -13.748 3.608 1.00 4.42 H new ATOM 0 HH22 ARG A 125 15.565 -14.580 2.400 1.00 4.42 H new ATOM 2125 N ILE A 126 17.190 -6.619 4.956 1.00 0.21 N ATOM 2126 CA ILE A 126 17.712 -5.761 3.906 1.00 0.21 C ATOM 2127 C ILE A 126 18.325 -4.512 4.527 1.00 0.20 C ATOM 2128 O ILE A 126 19.422 -4.103 4.167 1.00 0.21 O ATOM 2129 CB ILE A 126 16.616 -5.371 2.882 1.00 0.21 C ATOM 2130 CG1 ILE A 126 16.274 -6.572 1.995 1.00 0.23 C ATOM 2131 CG2 ILE A 126 17.059 -4.191 2.027 1.00 0.22 C ATOM 2132 CD1 ILE A 126 15.157 -6.304 1.010 1.00 0.25 C ATOM 0 H ILE A 126 16.173 -6.685 4.987 1.00 0.21 H new ATOM 0 HA ILE A 126 18.478 -6.316 3.364 1.00 0.21 H new ATOM 0 HB ILE A 126 15.725 -5.071 3.434 1.00 0.21 H new ATOM 0 HG12 ILE A 126 17.166 -6.872 1.446 1.00 0.23 H new ATOM 0 HG13 ILE A 126 15.993 -7.412 2.630 1.00 0.23 H new ATOM 0 HG21 ILE A 126 16.271 -3.939 1.318 1.00 0.22 H new ATOM 0 HG22 ILE A 126 17.258 -3.332 2.668 1.00 0.22 H new ATOM 0 HG23 ILE A 126 17.966 -4.456 1.483 1.00 0.22 H new ATOM 0 HD11 ILE A 126 14.972 -7.200 0.417 1.00 0.25 H new ATOM 0 HD12 ILE A 126 14.251 -6.034 1.552 1.00 0.25 H new ATOM 0 HD13 ILE A 126 15.443 -5.485 0.350 1.00 0.25 H new ATOM 2144 N ARG A 127 17.618 -3.939 5.492 1.00 0.19 N ATOM 2145 CA ARG A 127 18.080 -2.733 6.185 1.00 0.19 C ATOM 2146 C ARG A 127 19.382 -2.995 6.933 1.00 0.20 C ATOM 2147 O ARG A 127 20.280 -2.159 6.935 1.00 0.21 O ATOM 2148 CB ARG A 127 17.009 -2.246 7.168 1.00 0.21 C ATOM 2149 CG ARG A 127 16.993 -0.739 7.373 1.00 0.68 C ATOM 2150 CD ARG A 127 15.652 -0.135 6.978 1.00 0.86 C ATOM 2151 NE ARG A 127 14.948 0.445 8.123 1.00 1.25 N ATOM 2152 CZ ARG A 127 13.621 0.436 8.264 1.00 1.55 C ATOM 2153 NH1 ARG A 127 12.855 -0.165 7.360 1.00 1.70 N ATOM 2154 NH2 ARG A 127 13.063 1.020 9.316 1.00 2.38 N ATOM 0 H ARG A 127 16.717 -4.289 5.817 1.00 0.19 H new ATOM 0 HA ARG A 127 18.262 -1.963 5.435 1.00 0.19 H new ATOM 0 HB2 ARG A 127 16.030 -2.563 6.809 1.00 0.21 H new ATOM 0 HB3 ARG A 127 17.168 -2.731 8.131 1.00 0.21 H new ATOM 0 HG2 ARG A 127 17.202 -0.511 8.418 1.00 0.68 H new ATOM 0 HG3 ARG A 127 17.787 -0.282 6.782 1.00 0.68 H new ATOM 0 HD2 ARG A 127 15.811 0.635 6.223 1.00 0.86 H new ATOM 0 HD3 ARG A 127 15.029 -0.905 6.522 1.00 0.86 H new ATOM 0 HE ARG A 127 15.505 0.882 8.857 1.00 1.25 H new ATOM 0 HH11 ARG A 127 13.281 -0.622 6.554 1.00 1.70 H new ATOM 0 HH12 ARG A 127 11.841 -0.169 7.472 1.00 1.70 H new ATOM 0 HH21 ARG A 127 13.648 1.476 10.016 1.00 2.38 H new ATOM 0 HH22 ARG A 127 12.049 1.014 9.425 1.00 2.38 H new ATOM 2168 N ALA A 128 19.477 -4.154 7.568 1.00 0.20 N ATOM 2169 CA ALA A 128 20.675 -4.514 8.317 1.00 0.22 C ATOM 2170 C ALA A 128 21.798 -4.929 7.384 1.00 0.22 C ATOM 2171 O ALA A 128 22.968 -4.643 7.649 1.00 0.23 O ATOM 2172 CB ALA A 128 20.374 -5.617 9.322 1.00 0.24 C ATOM 0 H ALA A 128 18.742 -4.861 7.581 1.00 0.20 H new ATOM 0 HA ALA A 128 21.003 -3.632 8.867 1.00 0.22 H new ATOM 0 HB1 ALA A 128 21.283 -5.869 9.869 1.00 0.24 H new ATOM 0 HB2 ALA A 128 19.613 -5.273 10.022 1.00 0.24 H new ATOM 0 HB3 ALA A 128 20.011 -6.500 8.796 1.00 0.24 H new ATOM 2178 N ALA A 129 21.452 -5.597 6.292 1.00 0.21 N ATOM 2179 CA ALA A 129 22.459 -6.021 5.331 1.00 0.22 C ATOM 2180 C ALA A 129 22.999 -4.817 4.578 1.00 0.21 C ATOM 2181 O ALA A 129 24.206 -4.702 4.345 1.00 0.22 O ATOM 2182 CB ALA A 129 21.894 -7.047 4.363 1.00 0.23 C ATOM 0 H ALA A 129 20.495 -5.854 6.052 1.00 0.21 H new ATOM 0 HA ALA A 129 23.277 -6.493 5.876 1.00 0.22 H new ATOM 0 HB1 ALA A 129 22.668 -7.346 3.657 1.00 0.23 H new ATOM 0 HB2 ALA A 129 21.552 -7.921 4.918 1.00 0.23 H new ATOM 0 HB3 ALA A 129 21.056 -6.611 3.820 1.00 0.23 H new ATOM 2188 N LEU A 130 22.102 -3.911 4.209 1.00 0.19 N ATOM 2189 CA LEU A 130 22.489 -2.709 3.495 1.00 0.19 C ATOM 2190 C LEU A 130 23.203 -1.739 4.426 1.00 0.19 C ATOM 2191 O LEU A 130 24.031 -0.945 3.986 1.00 0.19 O ATOM 2192 CB LEU A 130 21.263 -2.045 2.874 1.00 0.19 C ATOM 2193 CG LEU A 130 20.848 -2.588 1.501 1.00 0.20 C ATOM 2194 CD1 LEU A 130 19.677 -1.795 0.945 1.00 0.23 C ATOM 2195 CD2 LEU A 130 22.017 -2.568 0.526 1.00 0.21 C ATOM 0 H LEU A 130 21.102 -3.989 4.394 1.00 0.19 H new ATOM 0 HA LEU A 130 23.177 -2.988 2.697 1.00 0.19 H new ATOM 0 HB2 LEU A 130 20.423 -2.157 3.560 1.00 0.19 H new ATOM 0 HB3 LEU A 130 21.457 -0.977 2.780 1.00 0.19 H new ATOM 0 HG LEU A 130 20.536 -3.624 1.631 1.00 0.20 H new ATOM 0 HD11 LEU A 130 19.397 -2.195 -0.030 1.00 0.23 H new ATOM 0 HD12 LEU A 130 18.829 -1.872 1.626 1.00 0.23 H new ATOM 0 HD13 LEU A 130 19.964 -0.749 0.839 1.00 0.23 H new ATOM 0 HD21 LEU A 130 21.693 -2.959 -0.439 1.00 0.21 H new ATOM 0 HD22 LEU A 130 22.371 -1.544 0.403 1.00 0.21 H new ATOM 0 HD23 LEU A 130 22.826 -3.187 0.915 1.00 0.21 H new ATOM 2207 N LYS A 131 22.875 -1.815 5.712 1.00 0.19 N ATOM 2208 CA LYS A 131 23.486 -0.959 6.728 1.00 0.19 C ATOM 2209 C LYS A 131 25.004 -1.088 6.701 1.00 0.20 C ATOM 2210 O LYS A 131 25.728 -0.120 6.937 1.00 0.22 O ATOM 2211 CB LYS A 131 22.966 -1.350 8.105 1.00 0.22 C ATOM 2212 CG LYS A 131 22.816 -0.185 9.062 1.00 0.41 C ATOM 2213 CD LYS A 131 22.300 -0.661 10.408 1.00 0.61 C ATOM 2214 CE LYS A 131 20.810 -0.959 10.361 1.00 1.34 C ATOM 2215 NZ LYS A 131 20.363 -1.734 11.547 1.00 1.79 N ATOM 0 H LYS A 131 22.182 -2.467 6.080 1.00 0.19 H new ATOM 0 HA LYS A 131 23.221 0.076 6.514 1.00 0.19 H new ATOM 0 HB2 LYS A 131 21.999 -1.840 7.991 1.00 0.22 H new ATOM 0 HB3 LYS A 131 23.644 -2.082 8.544 1.00 0.22 H new ATOM 0 HG2 LYS A 131 23.777 0.313 9.191 1.00 0.41 H new ATOM 0 HG3 LYS A 131 22.129 0.551 8.643 1.00 0.41 H new ATOM 0 HD2 LYS A 131 22.842 -1.557 10.710 1.00 0.61 H new ATOM 0 HD3 LYS A 131 22.496 0.100 11.164 1.00 0.61 H new ATOM 0 HE2 LYS A 131 20.254 -0.023 10.308 1.00 1.34 H new ATOM 0 HE3 LYS A 131 20.580 -1.518 9.454 1.00 1.34 H new ATOM 0 HZ1 LYS A 131 19.342 -1.917 11.477 1.00 1.79 H new ATOM 0 HZ2 LYS A 131 20.875 -2.638 11.584 1.00 1.79 H new ATOM 0 HZ3 LYS A 131 20.559 -1.190 12.411 1.00 1.79 H new ATOM 2229 N LYS A 132 25.474 -2.298 6.420 1.00 0.22 N ATOM 2230 CA LYS A 132 26.904 -2.569 6.337 1.00 0.24 C ATOM 2231 C LYS A 132 27.530 -1.803 5.171 1.00 0.23 C ATOM 2232 O LYS A 132 28.697 -1.417 5.213 1.00 0.25 O ATOM 2233 CB LYS A 132 27.140 -4.067 6.166 1.00 0.28 C ATOM 2234 CG LYS A 132 27.457 -4.799 7.463 1.00 0.39 C ATOM 2235 CD LYS A 132 28.950 -4.811 7.766 1.00 0.57 C ATOM 2236 CE LYS A 132 29.445 -3.445 8.218 1.00 1.06 C ATOM 2237 NZ LYS A 132 30.873 -3.475 8.626 1.00 1.52 N ATOM 0 H LYS A 132 24.882 -3.110 6.245 1.00 0.22 H new ATOM 0 HA LYS A 132 27.375 -2.236 7.262 1.00 0.24 H new ATOM 0 HB2 LYS A 132 26.254 -4.514 5.716 1.00 0.28 H new ATOM 0 HB3 LYS A 132 27.962 -4.217 5.467 1.00 0.28 H new ATOM 0 HG2 LYS A 132 26.925 -4.323 8.286 1.00 0.39 H new ATOM 0 HG3 LYS A 132 27.093 -5.824 7.398 1.00 0.39 H new ATOM 0 HD2 LYS A 132 29.158 -5.548 8.542 1.00 0.57 H new ATOM 0 HD3 LYS A 132 29.499 -5.121 6.877 1.00 0.57 H new ATOM 0 HE2 LYS A 132 29.315 -2.727 7.409 1.00 1.06 H new ATOM 0 HE3 LYS A 132 28.837 -3.098 9.053 1.00 1.06 H new ATOM 0 HZ1 LYS A 132 31.168 -2.524 8.926 1.00 1.52 H new ATOM 0 HZ2 LYS A 132 30.995 -4.141 9.416 1.00 1.52 H new ATOM 0 HZ3 LYS A 132 31.457 -3.781 7.822 1.00 1.52 H new ATOM 2251 N LYS A 133 26.725 -1.587 4.142 1.00 0.22 N ATOM 2252 CA LYS A 133 27.143 -0.857 2.949 1.00 0.25 C ATOM 2253 C LYS A 133 26.860 0.632 3.129 1.00 0.23 C ATOM 2254 O LYS A 133 27.062 1.430 2.210 1.00 0.25 O ATOM 2255 CB LYS A 133 26.371 -1.373 1.731 1.00 0.30 C ATOM 2256 CG LYS A 133 27.201 -1.483 0.462 1.00 0.49 C ATOM 2257 CD LYS A 133 26.325 -1.369 -0.778 1.00 0.65 C ATOM 2258 CE LYS A 133 27.020 -1.914 -2.017 1.00 1.12 C ATOM 2259 NZ LYS A 133 26.897 -3.392 -2.113 1.00 1.56 N ATOM 0 H LYS A 133 25.759 -1.913 4.108 1.00 0.22 H new ATOM 0 HA LYS A 133 28.211 -1.009 2.796 1.00 0.25 H new ATOM 0 HB2 LYS A 133 25.958 -2.354 1.967 1.00 0.30 H new ATOM 0 HB3 LYS A 133 25.528 -0.709 1.543 1.00 0.30 H new ATOM 0 HG2 LYS A 133 27.958 -0.699 0.450 1.00 0.49 H new ATOM 0 HG3 LYS A 133 27.730 -2.436 0.451 1.00 0.49 H new ATOM 0 HD2 LYS A 133 25.394 -1.912 -0.616 1.00 0.65 H new ATOM 0 HD3 LYS A 133 26.060 -0.324 -0.940 1.00 0.65 H new ATOM 0 HE2 LYS A 133 26.590 -1.455 -2.907 1.00 1.12 H new ATOM 0 HE3 LYS A 133 28.074 -1.638 -1.994 1.00 1.12 H new ATOM 0 HZ1 LYS A 133 27.383 -3.726 -2.970 1.00 1.56 H new ATOM 0 HZ2 LYS A 133 27.330 -3.832 -1.276 1.00 1.56 H new ATOM 0 HZ3 LYS A 133 25.892 -3.654 -2.161 1.00 1.56 H new ATOM 2273 N ASN A 134 26.377 0.978 4.325 1.00 0.20 N ATOM 2274 CA ASN A 134 26.025 2.349 4.689 1.00 0.21 C ATOM 2275 C ASN A 134 24.753 2.781 3.963 1.00 0.21 C ATOM 2276 O ASN A 134 24.486 3.973 3.793 1.00 0.26 O ATOM 2277 CB ASN A 134 27.176 3.319 4.395 1.00 0.25 C ATOM 2278 CG ASN A 134 27.193 4.507 5.338 1.00 0.31 C ATOM 2279 OD1 ASN A 134 26.481 5.491 5.134 1.00 1.09 O ATOM 2280 ND2 ASN A 134 28.014 4.430 6.372 1.00 1.15 N ATOM 0 H ASN A 134 26.218 0.305 5.075 1.00 0.20 H new ATOM 0 HA ASN A 134 25.839 2.376 5.763 1.00 0.21 H new ATOM 0 HB2 ASN A 134 28.124 2.786 4.471 1.00 0.25 H new ATOM 0 HB3 ASN A 134 27.092 3.676 3.368 1.00 0.25 H new ATOM 0 HD21 ASN A 134 28.073 5.203 7.035 1.00 1.15 H new ATOM 0 HD22 ASN A 134 28.588 3.598 6.507 1.00 1.15 H new ATOM 2287 N TYR A 135 23.968 1.796 3.542 1.00 0.19 N ATOM 2288 CA TYR A 135 22.713 2.045 2.849 1.00 0.19 C ATOM 2289 C TYR A 135 21.546 1.807 3.794 1.00 0.19 C ATOM 2290 O TYR A 135 21.376 0.720 4.341 1.00 0.20 O ATOM 2291 CB TYR A 135 22.584 1.136 1.621 1.00 0.20 C ATOM 2292 CG TYR A 135 22.439 1.873 0.306 1.00 0.24 C ATOM 2293 CD1 TYR A 135 21.476 2.863 0.140 1.00 1.21 C ATOM 2294 CD2 TYR A 135 23.266 1.575 -0.769 1.00 1.21 C ATOM 2295 CE1 TYR A 135 21.343 3.530 -1.064 1.00 1.26 C ATOM 2296 CE2 TYR A 135 23.138 2.239 -1.974 1.00 1.22 C ATOM 2297 CZ TYR A 135 22.177 3.216 -2.116 1.00 0.43 C ATOM 2298 OH TYR A 135 22.052 3.888 -3.313 1.00 0.55 O ATOM 0 H TYR A 135 24.184 0.807 3.671 1.00 0.19 H new ATOM 0 HA TYR A 135 22.701 3.082 2.514 1.00 0.19 H new ATOM 0 HB2 TYR A 135 23.462 0.492 1.567 1.00 0.20 H new ATOM 0 HB3 TYR A 135 21.720 0.485 1.756 1.00 0.20 H new ATOM 0 HD1 TYR A 135 20.823 3.114 0.963 1.00 1.21 H new ATOM 0 HD2 TYR A 135 24.022 0.811 -0.661 1.00 1.21 H new ATOM 0 HE1 TYR A 135 20.589 4.294 -1.180 1.00 1.26 H new ATOM 0 HE2 TYR A 135 23.788 1.993 -2.801 1.00 1.22 H new ATOM 0 HH TYR A 135 22.715 3.548 -3.950 1.00 0.55 H new ATOM 2308 N LYS A 136 20.761 2.839 3.995 1.00 0.19 N ATOM 2309 CA LYS A 136 19.608 2.771 4.864 1.00 0.20 C ATOM 2310 C LYS A 136 18.356 3.112 4.089 1.00 0.20 C ATOM 2311 O LYS A 136 18.360 4.022 3.275 1.00 0.22 O ATOM 2312 CB LYS A 136 19.788 3.731 6.026 1.00 0.22 C ATOM 2313 CG LYS A 136 20.537 3.107 7.183 1.00 0.28 C ATOM 2314 CD LYS A 136 21.722 3.958 7.622 1.00 0.58 C ATOM 2315 CE LYS A 136 21.278 5.302 8.179 1.00 1.52 C ATOM 2316 NZ LYS A 136 22.432 6.189 8.477 1.00 1.80 N ATOM 0 H LYS A 136 20.903 3.751 3.561 1.00 0.19 H new ATOM 0 HA LYS A 136 19.510 1.758 5.254 1.00 0.20 H new ATOM 0 HB2 LYS A 136 20.327 4.614 5.683 1.00 0.22 H new ATOM 0 HB3 LYS A 136 18.810 4.067 6.370 1.00 0.22 H new ATOM 0 HG2 LYS A 136 19.857 2.971 8.024 1.00 0.28 H new ATOM 0 HG3 LYS A 136 20.889 2.117 6.895 1.00 0.28 H new ATOM 0 HD2 LYS A 136 22.294 3.422 8.380 1.00 0.58 H new ATOM 0 HD3 LYS A 136 22.388 4.118 6.774 1.00 0.58 H new ATOM 0 HE2 LYS A 136 20.620 5.792 7.462 1.00 1.52 H new ATOM 0 HE3 LYS A 136 20.698 5.144 9.088 1.00 1.52 H new ATOM 0 HZ1 LYS A 136 22.086 7.094 8.854 1.00 1.80 H new ATOM 0 HZ2 LYS A 136 23.048 5.733 9.181 1.00 1.80 H new ATOM 0 HZ3 LYS A 136 22.972 6.361 7.605 1.00 1.80 H new ATOM 2330 N LEU A 137 17.298 2.378 4.349 1.00 0.19 N ATOM 2331 CA LEU A 137 16.027 2.582 3.660 1.00 0.20 C ATOM 2332 C LEU A 137 15.028 3.279 4.574 1.00 0.23 C ATOM 2333 O LEU A 137 14.981 2.987 5.771 1.00 0.25 O ATOM 2334 CB LEU A 137 15.432 1.237 3.225 1.00 0.23 C ATOM 2335 CG LEU A 137 16.370 0.266 2.490 1.00 0.23 C ATOM 2336 CD1 LEU A 137 17.210 0.991 1.449 1.00 0.22 C ATOM 2337 CD2 LEU A 137 17.252 -0.487 3.475 1.00 0.25 C ATOM 0 H LEU A 137 17.285 1.626 5.038 1.00 0.19 H new ATOM 0 HA LEU A 137 16.220 3.203 2.785 1.00 0.20 H new ATOM 0 HB2 LEU A 137 15.049 0.733 4.112 1.00 0.23 H new ATOM 0 HB3 LEU A 137 14.577 1.437 2.579 1.00 0.23 H new ATOM 0 HG LEU A 137 15.751 -0.462 1.966 1.00 0.23 H new ATOM 0 HD11 LEU A 137 17.863 0.277 0.947 1.00 0.22 H new ATOM 0 HD12 LEU A 137 16.555 1.461 0.716 1.00 0.22 H new ATOM 0 HD13 LEU A 137 17.815 1.755 1.937 1.00 0.22 H new ATOM 0 HD21 LEU A 137 17.907 -1.168 2.931 1.00 0.25 H new ATOM 0 HD22 LEU A 137 17.856 0.223 4.039 1.00 0.25 H new ATOM 0 HD23 LEU A 137 16.626 -1.057 4.162 1.00 0.25 H new ATOM 2349 N ASN A 138 14.228 4.189 4.023 1.00 0.24 N ATOM 2350 CA ASN A 138 13.235 4.888 4.814 1.00 0.30 C ATOM 2351 C ASN A 138 12.071 5.286 3.940 1.00 0.38 C ATOM 2352 O ASN A 138 12.216 5.389 2.716 1.00 0.37 O ATOM 2353 CB ASN A 138 13.843 6.119 5.488 1.00 0.34 C ATOM 2354 CG ASN A 138 12.878 6.771 6.457 1.00 0.47 C ATOM 2355 OD1 ASN A 138 12.039 6.105 7.062 1.00 1.20 O ATOM 2356 ND2 ASN A 138 12.978 8.076 6.604 1.00 0.96 N ATOM 0 H ASN A 138 14.252 4.454 3.038 1.00 0.24 H new ATOM 0 HA ASN A 138 12.879 4.218 5.596 1.00 0.30 H new ATOM 0 HB2 ASN A 138 14.750 5.831 6.019 1.00 0.34 H new ATOM 0 HB3 ASN A 138 14.136 6.842 4.726 1.00 0.34 H new ATOM 0 HD21 ASN A 138 12.347 8.568 7.237 1.00 0.96 H new ATOM 0 HD22 ASN A 138 13.687 8.595 6.085 1.00 0.96 H new ATOM 2363 N GLN A 139 10.907 5.497 4.559 1.00 0.47 N ATOM 2364 CA GLN A 139 9.723 5.910 3.824 1.00 0.58 C ATOM 2365 C GLN A 139 10.068 7.146 3.033 1.00 0.62 C ATOM 2366 O GLN A 139 9.465 7.418 1.998 1.00 0.71 O ATOM 2367 CB GLN A 139 8.523 6.164 4.744 1.00 0.69 C ATOM 2368 CG GLN A 139 8.869 6.841 6.056 1.00 0.83 C ATOM 2369 CD GLN A 139 8.366 6.062 7.257 1.00 1.61 C ATOM 2370 OE1 GLN A 139 8.359 4.739 7.153 1.00 2.30 O flip ATOM 2371 NE2 GLN A 139 7.987 6.642 8.273 1.00 2.08 N flip ATOM 0 H GLN A 139 10.765 5.388 5.563 1.00 0.47 H new ATOM 0 HA GLN A 139 9.423 5.103 3.156 1.00 0.58 H new ATOM 0 HB2 GLN A 139 7.797 6.780 4.212 1.00 0.69 H new ATOM 0 HB3 GLN A 139 8.037 5.212 4.958 1.00 0.69 H new ATOM 0 HG2 GLN A 139 9.950 6.957 6.128 1.00 0.83 H new ATOM 0 HG3 GLN A 139 8.439 7.843 6.070 1.00 0.83 H new ATOM 0 HE21 GLN A 139 8.007 7.661 8.316 1.00 2.08 H new ATOM 0 HE22 GLN A 139 7.653 6.104 9.073 1.00 2.08 H new ATOM 2380 N TYR A 140 11.056 7.898 3.515 1.00 0.58 N ATOM 2381 CA TYR A 140 11.489 9.041 2.789 1.00 0.64 C ATOM 2382 C TYR A 140 12.878 8.795 2.221 1.00 0.49 C ATOM 2383 O TYR A 140 13.829 9.523 2.507 1.00 0.55 O ATOM 2384 CB TYR A 140 11.568 10.221 3.730 1.00 0.83 C ATOM 2385 CG TYR A 140 10.257 10.914 3.993 1.00 1.13 C ATOM 2386 CD1 TYR A 140 9.310 10.358 4.839 1.00 1.83 C ATOM 2387 CD2 TYR A 140 9.975 12.139 3.403 1.00 1.76 C ATOM 2388 CE1 TYR A 140 8.118 11.004 5.093 1.00 2.16 C ATOM 2389 CE2 TYR A 140 8.782 12.789 3.650 1.00 2.14 C ATOM 2390 CZ TYR A 140 7.860 12.218 4.495 1.00 2.03 C ATOM 2391 OH TYR A 140 6.677 12.870 4.756 1.00 2.52 O ATOM 0 H TYR A 140 11.550 7.724 4.390 1.00 0.58 H new ATOM 0 HA TYR A 140 10.785 9.238 1.980 1.00 0.64 H new ATOM 0 HB2 TYR A 140 11.979 9.882 4.681 1.00 0.83 H new ATOM 0 HB3 TYR A 140 12.270 10.947 3.320 1.00 0.83 H new ATOM 0 HD1 TYR A 140 9.508 9.405 5.306 1.00 1.83 H new ATOM 0 HD2 TYR A 140 10.699 12.590 2.741 1.00 1.76 H new ATOM 0 HE1 TYR A 140 7.391 10.560 5.757 1.00 2.16 H new ATOM 0 HE2 TYR A 140 8.574 13.740 3.182 1.00 2.14 H new ATOM 0 HH TYR A 140 6.651 13.713 4.257 1.00 2.52 H new ATOM 2401 N GLY A 141 12.965 7.763 1.401 1.00 0.36 N ATOM 2402 CA GLY A 141 14.173 7.513 0.648 1.00 0.27 C ATOM 2403 C GLY A 141 15.204 6.667 1.341 1.00 0.23 C ATOM 2404 O GLY A 141 15.061 6.287 2.501 1.00 0.24 O ATOM 0 H GLY A 141 12.216 7.089 1.242 1.00 0.36 H new ATOM 0 HA2 GLY A 141 13.902 7.029 -0.290 1.00 0.27 H new ATOM 0 HA3 GLY A 141 14.626 8.471 0.393 1.00 0.27 H new ATOM 2408 N LEU A 142 16.236 6.348 0.584 1.00 0.21 N ATOM 2409 CA LEU A 142 17.357 5.579 1.075 1.00 0.19 C ATOM 2410 C LEU A 142 18.537 6.520 1.264 1.00 0.20 C ATOM 2411 O LEU A 142 18.779 7.396 0.444 1.00 0.24 O ATOM 2412 CB LEU A 142 17.734 4.441 0.110 1.00 0.20 C ATOM 2413 CG LEU A 142 17.091 4.480 -1.282 1.00 0.24 C ATOM 2414 CD1 LEU A 142 17.958 3.739 -2.289 1.00 0.27 C ATOM 2415 CD2 LEU A 142 15.703 3.866 -1.252 1.00 0.34 C ATOM 0 H LEU A 142 16.318 6.619 -0.396 1.00 0.21 H new ATOM 0 HA LEU A 142 17.081 5.116 2.023 1.00 0.19 H new ATOM 0 HB2 LEU A 142 18.817 4.445 -0.015 1.00 0.20 H new ATOM 0 HB3 LEU A 142 17.471 3.494 0.581 1.00 0.20 H new ATOM 0 HG LEU A 142 17.006 5.524 -1.584 1.00 0.24 H new ATOM 0 HD11 LEU A 142 17.487 3.776 -3.271 1.00 0.27 H new ATOM 0 HD12 LEU A 142 18.940 4.209 -2.339 1.00 0.27 H new ATOM 0 HD13 LEU A 142 18.069 2.700 -1.979 1.00 0.27 H new ATOM 0 HD21 LEU A 142 15.266 3.905 -2.250 1.00 0.34 H new ATOM 0 HD22 LEU A 142 15.771 2.828 -0.926 1.00 0.34 H new ATOM 0 HD23 LEU A 142 15.073 4.424 -0.559 1.00 0.34 H new ATOM 2427 N PHE A 143 19.247 6.372 2.359 1.00 0.20 N ATOM 2428 CA PHE A 143 20.382 7.227 2.641 1.00 0.23 C ATOM 2429 C PHE A 143 21.660 6.423 2.623 1.00 0.23 C ATOM 2430 O PHE A 143 21.832 5.483 3.402 1.00 0.24 O ATOM 2431 CB PHE A 143 20.207 7.910 3.994 1.00 0.26 C ATOM 2432 CG PHE A 143 18.776 8.243 4.314 1.00 0.28 C ATOM 2433 CD1 PHE A 143 18.016 9.012 3.445 1.00 1.23 C ATOM 2434 CD2 PHE A 143 18.192 7.782 5.480 1.00 1.22 C ATOM 2435 CE1 PHE A 143 16.702 9.311 3.736 1.00 1.25 C ATOM 2436 CE2 PHE A 143 16.876 8.081 5.776 1.00 1.23 C ATOM 2437 CZ PHE A 143 16.130 8.845 4.902 1.00 0.35 C ATOM 0 H PHE A 143 19.060 5.667 3.072 1.00 0.20 H new ATOM 0 HA PHE A 143 20.441 7.994 1.868 1.00 0.23 H new ATOM 0 HB2 PHE A 143 20.605 7.261 4.774 1.00 0.26 H new ATOM 0 HB3 PHE A 143 20.798 8.826 4.009 1.00 0.26 H new ATOM 0 HD1 PHE A 143 18.458 9.380 2.531 1.00 1.23 H new ATOM 0 HD2 PHE A 143 18.771 7.182 6.166 1.00 1.22 H new ATOM 0 HE1 PHE A 143 16.120 9.910 3.051 1.00 1.25 H new ATOM 0 HE2 PHE A 143 16.432 7.717 6.691 1.00 1.23 H new ATOM 0 HZ PHE A 143 15.100 9.078 5.130 1.00 0.35 H new ATOM 2447 N LYS A 144 22.544 6.784 1.717 1.00 0.24 N ATOM 2448 CA LYS A 144 23.819 6.101 1.586 1.00 0.27 C ATOM 2449 C LYS A 144 24.957 7.089 1.733 1.00 0.29 C ATOM 2450 O LYS A 144 25.014 8.086 1.020 1.00 0.30 O ATOM 2451 CB LYS A 144 23.905 5.390 0.240 1.00 0.30 C ATOM 2452 CG LYS A 144 25.210 4.644 0.023 1.00 0.40 C ATOM 2453 CD LYS A 144 25.912 5.138 -1.227 1.00 0.54 C ATOM 2454 CE LYS A 144 26.919 4.121 -1.739 1.00 1.20 C ATOM 2455 NZ LYS A 144 27.290 4.377 -3.156 1.00 1.67 N ATOM 0 H LYS A 144 22.405 7.549 1.057 1.00 0.24 H new ATOM 0 HA LYS A 144 23.898 5.355 2.377 1.00 0.27 H new ATOM 0 HB2 LYS A 144 23.077 4.686 0.158 1.00 0.30 H new ATOM 0 HB3 LYS A 144 23.780 6.124 -0.556 1.00 0.30 H new ATOM 0 HG2 LYS A 144 25.860 4.780 0.888 1.00 0.40 H new ATOM 0 HG3 LYS A 144 25.013 3.575 -0.063 1.00 0.40 H new ATOM 0 HD2 LYS A 144 25.174 5.343 -2.003 1.00 0.54 H new ATOM 0 HD3 LYS A 144 26.420 6.078 -1.013 1.00 0.54 H new ATOM 0 HE2 LYS A 144 27.814 4.151 -1.118 1.00 1.20 H new ATOM 0 HE3 LYS A 144 26.501 3.118 -1.648 1.00 1.20 H new ATOM 0 HZ1 LYS A 144 27.978 3.663 -3.469 1.00 1.67 H new ATOM 0 HZ2 LYS A 144 26.440 4.323 -3.753 1.00 1.67 H new ATOM 0 HZ3 LYS A 144 27.712 5.324 -3.239 1.00 1.67 H new ATOM 2469 N ASN A 145 25.851 6.801 2.667 1.00 0.33 N ATOM 2470 CA ASN A 145 27.001 7.658 2.943 1.00 0.37 C ATOM 2471 C ASN A 145 26.554 9.083 3.244 1.00 0.38 C ATOM 2472 O ASN A 145 27.198 10.049 2.828 1.00 0.41 O ATOM 2473 CB ASN A 145 27.983 7.644 1.775 1.00 0.41 C ATOM 2474 CG ASN A 145 29.203 6.800 2.076 1.00 0.73 C ATOM 2475 OD1 ASN A 145 30.217 7.299 2.564 1.00 1.40 O ATOM 2476 ND2 ASN A 145 29.102 5.510 1.807 1.00 1.35 N ATOM 0 H ASN A 145 25.803 5.969 3.255 1.00 0.33 H new ATOM 0 HA ASN A 145 27.509 7.263 3.823 1.00 0.37 H new ATOM 0 HB2 ASN A 145 27.485 7.258 0.886 1.00 0.41 H new ATOM 0 HB3 ASN A 145 28.294 8.664 1.549 1.00 0.41 H new ATOM 0 HD21 ASN A 145 29.884 4.885 2.004 1.00 1.35 H new ATOM 0 HD22 ASN A 145 28.242 5.139 1.403 1.00 1.35 H new ATOM 2483 N GLN A 146 25.422 9.187 3.946 1.00 0.36 N ATOM 2484 CA GLN A 146 24.839 10.473 4.346 1.00 0.40 C ATOM 2485 C GLN A 146 24.223 11.203 3.150 1.00 0.38 C ATOM 2486 O GLN A 146 23.897 12.387 3.222 1.00 0.46 O ATOM 2487 CB GLN A 146 25.891 11.350 5.031 1.00 0.48 C ATOM 2488 CG GLN A 146 25.316 12.393 5.971 1.00 0.93 C ATOM 2489 CD GLN A 146 26.376 13.332 6.498 1.00 1.34 C ATOM 2490 OE1 GLN A 146 26.629 14.387 5.920 1.00 2.04 O ATOM 2491 NE2 GLN A 146 27.018 12.946 7.589 1.00 1.78 N ATOM 0 H GLN A 146 24.881 8.379 4.255 1.00 0.36 H new ATOM 0 HA GLN A 146 24.039 10.270 5.058 1.00 0.40 H new ATOM 0 HB2 GLN A 146 26.573 10.710 5.591 1.00 0.48 H new ATOM 0 HB3 GLN A 146 26.482 11.853 4.266 1.00 0.48 H new ATOM 0 HG2 GLN A 146 24.551 12.968 5.449 1.00 0.93 H new ATOM 0 HG3 GLN A 146 24.826 11.895 6.807 1.00 0.93 H new ATOM 0 HE21 GLN A 146 26.776 12.062 8.037 1.00 1.78 H new ATOM 0 HE22 GLN A 146 27.755 13.532 7.982 1.00 1.78 H new ATOM 2500 N THR A 147 24.052 10.480 2.060 1.00 0.32 N ATOM 2501 CA THR A 147 23.474 11.041 0.855 1.00 0.33 C ATOM 2502 C THR A 147 22.070 10.499 0.656 1.00 0.30 C ATOM 2503 O THR A 147 21.872 9.294 0.478 1.00 0.28 O ATOM 2504 CB THR A 147 24.334 10.722 -0.377 1.00 0.36 C ATOM 2505 OG1 THR A 147 25.725 10.822 -0.030 1.00 0.41 O ATOM 2506 CG2 THR A 147 24.019 11.675 -1.521 1.00 0.45 C ATOM 0 H THR A 147 24.308 9.495 1.985 1.00 0.32 H new ATOM 0 HA THR A 147 23.435 12.124 0.971 1.00 0.33 H new ATOM 0 HB THR A 147 24.108 9.707 -0.705 1.00 0.36 H new ATOM 0 HG1 THR A 147 26.004 10.009 0.441 1.00 0.41 H new ATOM 0 HG21 THR A 147 24.641 11.429 -2.382 1.00 0.45 H new ATOM 0 HG22 THR A 147 22.968 11.581 -1.794 1.00 0.45 H new ATOM 0 HG23 THR A 147 24.222 12.699 -1.208 1.00 0.45 H new ATOM 2514 N LEU A 148 21.105 11.393 0.721 1.00 0.31 N ATOM 2515 CA LEU A 148 19.705 11.036 0.569 1.00 0.29 C ATOM 2516 C LEU A 148 19.355 10.757 -0.888 1.00 0.29 C ATOM 2517 O LEU A 148 19.407 11.652 -1.735 1.00 0.35 O ATOM 2518 CB LEU A 148 18.821 12.165 1.119 1.00 0.32 C ATOM 2519 CG LEU A 148 17.308 11.908 1.096 1.00 0.37 C ATOM 2520 CD1 LEU A 148 16.665 12.434 2.369 1.00 0.40 C ATOM 2521 CD2 LEU A 148 16.665 12.565 -0.117 1.00 0.54 C ATOM 0 H LEU A 148 21.266 12.387 0.880 1.00 0.31 H new ATOM 0 HA LEU A 148 19.523 10.122 1.134 1.00 0.29 H new ATOM 0 HB2 LEU A 148 19.120 12.365 2.148 1.00 0.32 H new ATOM 0 HB3 LEU A 148 19.024 13.070 0.547 1.00 0.32 H new ATOM 0 HG LEU A 148 17.148 10.832 1.033 1.00 0.37 H new ATOM 0 HD11 LEU A 148 15.592 12.245 2.339 1.00 0.40 H new ATOM 0 HD12 LEU A 148 17.099 11.928 3.232 1.00 0.40 H new ATOM 0 HD13 LEU A 148 16.843 13.506 2.450 1.00 0.40 H new ATOM 0 HD21 LEU A 148 15.593 12.369 -0.111 1.00 0.54 H new ATOM 0 HD22 LEU A 148 16.837 13.641 -0.082 1.00 0.54 H new ATOM 0 HD23 LEU A 148 17.104 12.157 -1.027 1.00 0.54 H new ATOM 2533 N VAL A 149 19.027 9.508 -1.177 1.00 0.25 N ATOM 2534 CA VAL A 149 18.624 9.123 -2.522 1.00 0.27 C ATOM 2535 C VAL A 149 17.222 8.500 -2.483 1.00 0.24 C ATOM 2536 O VAL A 149 17.015 7.434 -1.905 1.00 0.23 O ATOM 2537 CB VAL A 149 19.646 8.166 -3.199 1.00 0.29 C ATOM 2538 CG1 VAL A 149 20.062 7.037 -2.270 1.00 0.88 C ATOM 2539 CG2 VAL A 149 19.090 7.606 -4.502 1.00 1.04 C ATOM 0 H VAL A 149 19.031 8.744 -0.501 1.00 0.25 H new ATOM 0 HA VAL A 149 18.600 10.025 -3.134 1.00 0.27 H new ATOM 0 HB VAL A 149 20.535 8.754 -3.426 1.00 0.29 H new ATOM 0 HG11 VAL A 149 20.776 6.391 -2.780 1.00 0.88 H new ATOM 0 HG12 VAL A 149 20.524 7.454 -1.375 1.00 0.88 H new ATOM 0 HG13 VAL A 149 19.184 6.456 -1.988 1.00 0.88 H new ATOM 0 HG21 VAL A 149 19.825 6.940 -4.955 1.00 1.04 H new ATOM 0 HG22 VAL A 149 18.174 7.051 -4.298 1.00 1.04 H new ATOM 0 HG23 VAL A 149 18.873 8.426 -5.187 1.00 1.04 H new ATOM 2549 N PRO A 150 16.226 9.190 -3.061 1.00 0.26 N ATOM 2550 CA PRO A 150 14.844 8.715 -3.077 1.00 0.25 C ATOM 2551 C PRO A 150 14.615 7.576 -4.066 1.00 0.25 C ATOM 2552 O PRO A 150 15.381 7.388 -5.013 1.00 0.28 O ATOM 2553 CB PRO A 150 14.050 9.951 -3.497 1.00 0.31 C ATOM 2554 CG PRO A 150 15.004 10.747 -4.316 1.00 0.37 C ATOM 2555 CD PRO A 150 16.371 10.490 -3.738 1.00 0.31 C ATOM 0 HA PRO A 150 14.552 8.304 -2.111 1.00 0.25 H new ATOM 0 HB2 PRO A 150 13.165 9.678 -4.072 1.00 0.31 H new ATOM 0 HB3 PRO A 150 13.705 10.515 -2.630 1.00 0.31 H new ATOM 0 HG2 PRO A 150 14.962 10.448 -5.363 1.00 0.37 H new ATOM 0 HG3 PRO A 150 14.758 11.808 -4.278 1.00 0.37 H new ATOM 0 HD2 PRO A 150 17.134 10.453 -4.516 1.00 0.31 H new ATOM 0 HD3 PRO A 150 16.664 11.274 -3.040 1.00 0.31 H new ATOM 2563 N LEU A 151 13.548 6.832 -3.835 1.00 0.25 N ATOM 2564 CA LEU A 151 13.187 5.701 -4.677 1.00 0.28 C ATOM 2565 C LEU A 151 12.390 6.141 -5.907 1.00 0.48 C ATOM 2566 O LEU A 151 11.161 6.123 -5.907 1.00 1.50 O ATOM 2567 CB LEU A 151 12.385 4.630 -3.895 1.00 0.51 C ATOM 2568 CG LEU A 151 11.548 5.076 -2.670 1.00 0.27 C ATOM 2569 CD1 LEU A 151 12.442 5.388 -1.482 1.00 0.47 C ATOM 2570 CD2 LEU A 151 10.649 6.265 -2.985 1.00 0.48 C ATOM 0 H LEU A 151 12.906 6.993 -3.059 1.00 0.25 H new ATOM 0 HA LEU A 151 14.126 5.257 -5.009 1.00 0.28 H new ATOM 0 HB2 LEU A 151 11.709 4.144 -4.598 1.00 0.51 H new ATOM 0 HB3 LEU A 151 13.090 3.871 -3.555 1.00 0.51 H new ATOM 0 HG LEU A 151 10.901 4.238 -2.411 1.00 0.27 H new ATOM 0 HD11 LEU A 151 11.828 5.698 -0.636 1.00 0.47 H new ATOM 0 HD12 LEU A 151 13.010 4.498 -1.211 1.00 0.47 H new ATOM 0 HD13 LEU A 151 13.130 6.191 -1.745 1.00 0.47 H new ATOM 0 HD21 LEU A 151 10.083 6.539 -2.095 1.00 0.48 H new ATOM 0 HD22 LEU A 151 11.261 7.110 -3.301 1.00 0.48 H new ATOM 0 HD23 LEU A 151 9.959 5.997 -3.785 1.00 0.48 H new ATOM 2582 N LYS A 152 13.091 6.529 -6.957 1.00 0.64 N ATOM 2583 CA LYS A 152 12.432 6.953 -8.182 1.00 0.53 C ATOM 2584 C LYS A 152 12.558 5.866 -9.245 1.00 0.49 C ATOM 2585 O LYS A 152 13.467 5.899 -10.078 1.00 0.63 O ATOM 2586 CB LYS A 152 13.024 8.272 -8.686 1.00 0.55 C ATOM 2587 CG LYS A 152 12.013 9.153 -9.404 1.00 1.12 C ATOM 2588 CD LYS A 152 10.943 9.668 -8.453 1.00 1.33 C ATOM 2589 CE LYS A 152 11.221 11.098 -8.018 1.00 1.84 C ATOM 2590 NZ LYS A 152 10.264 12.057 -8.628 1.00 2.27 N ATOM 0 H LYS A 152 14.110 6.560 -6.988 1.00 0.64 H new ATOM 0 HA LYS A 152 11.375 7.116 -7.972 1.00 0.53 H new ATOM 0 HB2 LYS A 152 13.439 8.822 -7.841 1.00 0.55 H new ATOM 0 HB3 LYS A 152 13.851 8.056 -9.362 1.00 0.55 H new ATOM 0 HG2 LYS A 152 12.527 9.996 -9.865 1.00 1.12 H new ATOM 0 HG3 LYS A 152 11.543 8.587 -10.209 1.00 1.12 H new ATOM 0 HD2 LYS A 152 9.969 9.618 -8.939 1.00 1.33 H new ATOM 0 HD3 LYS A 152 10.895 9.023 -7.576 1.00 1.33 H new ATOM 0 HE2 LYS A 152 11.160 11.166 -6.932 1.00 1.84 H new ATOM 0 HE3 LYS A 152 12.238 11.372 -8.298 1.00 1.84 H new ATOM 0 HZ1 LYS A 152 10.699 13.000 -8.674 1.00 2.27 H new ATOM 0 HZ2 LYS A 152 10.021 11.741 -9.589 1.00 2.27 H new ATOM 0 HZ3 LYS A 152 9.401 12.102 -8.049 1.00 2.27 H new ATOM 2604 N ILE A 153 11.653 4.894 -9.195 1.00 0.42 N ATOM 2605 CA ILE A 153 11.654 3.784 -10.135 1.00 0.41 C ATOM 2606 C ILE A 153 10.237 3.487 -10.611 1.00 0.46 C ATOM 2607 O ILE A 153 9.293 4.189 -10.249 1.00 0.53 O ATOM 2608 CB ILE A 153 12.269 2.501 -9.531 1.00 0.36 C ATOM 2609 CG1 ILE A 153 11.787 2.293 -8.087 1.00 0.34 C ATOM 2610 CG2 ILE A 153 13.792 2.550 -9.609 1.00 0.52 C ATOM 2611 CD1 ILE A 153 12.712 2.866 -7.028 1.00 0.45 C ATOM 0 H ILE A 153 10.903 4.855 -8.505 1.00 0.42 H new ATOM 0 HA ILE A 153 12.274 4.089 -10.978 1.00 0.41 H new ATOM 0 HB ILE A 153 11.932 1.646 -10.117 1.00 0.36 H new ATOM 0 HG12 ILE A 153 10.803 2.748 -7.977 1.00 0.34 H new ATOM 0 HG13 ILE A 153 11.667 1.225 -7.907 1.00 0.34 H new ATOM 0 HG21 ILE A 153 14.208 1.639 -9.179 1.00 0.52 H new ATOM 0 HG22 ILE A 153 14.100 2.633 -10.651 1.00 0.52 H new ATOM 0 HG23 ILE A 153 14.157 3.413 -9.052 1.00 0.52 H new ATOM 0 HD11 ILE A 153 12.296 2.675 -6.039 1.00 0.45 H new ATOM 0 HD12 ILE A 153 13.692 2.394 -7.107 1.00 0.45 H new ATOM 0 HD13 ILE A 153 12.814 3.941 -7.177 1.00 0.45 H new ATOM 2623 N THR A 154 10.094 2.442 -11.408 1.00 0.51 N ATOM 2624 CA THR A 154 8.801 2.075 -11.968 1.00 0.62 C ATOM 2625 C THR A 154 8.009 1.075 -11.124 1.00 0.50 C ATOM 2626 O THR A 154 6.818 1.275 -10.888 1.00 0.54 O ATOM 2627 CB THR A 154 8.972 1.498 -13.377 1.00 0.81 C ATOM 2628 OG1 THR A 154 9.986 0.487 -13.366 1.00 1.76 O ATOM 2629 CG2 THR A 154 9.348 2.590 -14.362 1.00 1.20 C ATOM 0 H THR A 154 10.861 1.829 -11.684 1.00 0.51 H new ATOM 0 HA THR A 154 8.227 3.002 -11.988 1.00 0.62 H new ATOM 0 HB THR A 154 8.024 1.060 -13.690 1.00 0.81 H new ATOM 0 HG1 THR A 154 10.091 0.119 -14.268 1.00 1.76 H new ATOM 0 HG21 THR A 154 9.465 2.159 -15.356 1.00 1.20 H new ATOM 0 HG22 THR A 154 8.563 3.346 -14.384 1.00 1.20 H new ATOM 0 HG23 THR A 154 10.287 3.050 -14.054 1.00 1.20 H new ATOM 2637 N THR A 155 8.645 0.005 -10.666 1.00 0.41 N ATOM 2638 CA THR A 155 7.923 -1.006 -9.898 1.00 0.40 C ATOM 2639 C THR A 155 8.728 -1.548 -8.716 1.00 0.38 C ATOM 2640 O THR A 155 9.851 -1.112 -8.464 1.00 0.35 O ATOM 2641 CB THR A 155 7.509 -2.174 -10.803 1.00 0.45 C ATOM 2642 OG1 THR A 155 7.865 -1.897 -12.166 1.00 1.11 O ATOM 2643 CG2 THR A 155 6.011 -2.434 -10.709 1.00 1.00 C ATOM 0 H THR A 155 9.637 -0.186 -10.807 1.00 0.41 H new ATOM 0 HA THR A 155 7.041 -0.509 -9.495 1.00 0.40 H new ATOM 0 HB THR A 155 8.038 -3.065 -10.464 1.00 0.45 H new ATOM 0 HG1 THR A 155 7.598 -2.650 -12.733 1.00 1.11 H new ATOM 0 HG21 THR A 155 5.745 -3.267 -11.360 1.00 1.00 H new ATOM 0 HG22 THR A 155 5.748 -2.680 -9.680 1.00 1.00 H new ATOM 0 HG23 THR A 155 5.467 -1.542 -11.019 1.00 1.00 H new ATOM 2651 N GLU A 156 8.123 -2.505 -8.004 1.00 0.42 N ATOM 2652 CA GLU A 156 8.730 -3.151 -6.837 1.00 0.44 C ATOM 2653 C GLU A 156 10.100 -3.734 -7.179 1.00 0.39 C ATOM 2654 O GLU A 156 11.091 -3.431 -6.514 1.00 0.35 O ATOM 2655 CB GLU A 156 7.794 -4.251 -6.325 1.00 0.59 C ATOM 2656 CG GLU A 156 8.267 -4.944 -5.055 1.00 0.63 C ATOM 2657 CD GLU A 156 7.370 -6.103 -4.661 1.00 1.32 C ATOM 2658 OE1 GLU A 156 6.872 -6.803 -5.567 1.00 1.90 O ATOM 2659 OE2 GLU A 156 7.154 -6.306 -3.448 1.00 2.02 O ATOM 0 H GLU A 156 7.191 -2.855 -8.224 1.00 0.42 H new ATOM 0 HA GLU A 156 8.876 -2.403 -6.058 1.00 0.44 H new ATOM 0 HB2 GLU A 156 6.811 -3.817 -6.142 1.00 0.59 H new ATOM 0 HB3 GLU A 156 7.672 -5.000 -7.108 1.00 0.59 H new ATOM 0 HG2 GLU A 156 9.284 -5.308 -5.200 1.00 0.63 H new ATOM 0 HG3 GLU A 156 8.301 -4.221 -4.240 1.00 0.63 H new ATOM 2666 N LYS A 157 10.148 -4.555 -8.228 1.00 0.41 N ATOM 2667 CA LYS A 157 11.394 -5.173 -8.674 1.00 0.41 C ATOM 2668 C LYS A 157 12.468 -4.109 -8.900 1.00 0.36 C ATOM 2669 O LYS A 157 13.579 -4.212 -8.376 1.00 0.35 O ATOM 2670 CB LYS A 157 11.149 -5.967 -9.962 1.00 0.47 C ATOM 2671 CG LYS A 157 12.419 -6.429 -10.659 1.00 1.15 C ATOM 2672 CD LYS A 157 12.103 -7.304 -11.862 1.00 1.40 C ATOM 2673 CE LYS A 157 13.241 -7.302 -12.867 1.00 2.34 C ATOM 2674 NZ LYS A 157 13.178 -6.124 -13.773 1.00 2.88 N ATOM 0 H LYS A 157 9.333 -4.808 -8.787 1.00 0.41 H new ATOM 0 HA LYS A 157 11.746 -5.855 -7.900 1.00 0.41 H new ATOM 0 HB2 LYS A 157 10.538 -6.839 -9.728 1.00 0.47 H new ATOM 0 HB3 LYS A 157 10.573 -5.350 -10.652 1.00 0.47 H new ATOM 0 HG2 LYS A 157 12.996 -5.562 -10.979 1.00 1.15 H new ATOM 0 HG3 LYS A 157 13.041 -6.984 -9.956 1.00 1.15 H new ATOM 0 HD2 LYS A 157 11.911 -8.324 -11.530 1.00 1.40 H new ATOM 0 HD3 LYS A 157 11.192 -6.948 -12.342 1.00 1.40 H new ATOM 0 HE2 LYS A 157 14.193 -7.302 -12.337 1.00 2.34 H new ATOM 0 HE3 LYS A 157 13.205 -8.217 -13.458 1.00 2.34 H new ATOM 0 HZ1 LYS A 157 13.863 -6.244 -14.546 1.00 2.88 H new ATOM 0 HZ2 LYS A 157 12.220 -6.042 -14.169 1.00 2.88 H new ATOM 0 HZ3 LYS A 157 13.407 -5.262 -13.238 1.00 2.88 H new ATOM 2688 N GLU A 158 12.120 -3.082 -9.670 1.00 0.35 N ATOM 2689 CA GLU A 158 13.042 -1.989 -9.967 1.00 0.34 C ATOM 2690 C GLU A 158 13.478 -1.275 -8.693 1.00 0.29 C ATOM 2691 O GLU A 158 14.625 -0.835 -8.578 1.00 0.30 O ATOM 2692 CB GLU A 158 12.395 -0.998 -10.934 1.00 0.39 C ATOM 2693 CG GLU A 158 11.938 -1.638 -12.236 1.00 0.61 C ATOM 2694 CD GLU A 158 12.968 -2.590 -12.813 1.00 1.09 C ATOM 2695 OE1 GLU A 158 13.944 -2.121 -13.432 1.00 1.85 O ATOM 2696 OE2 GLU A 158 12.807 -3.814 -12.639 1.00 1.83 O ATOM 0 H GLU A 158 11.201 -2.983 -10.102 1.00 0.35 H new ATOM 0 HA GLU A 158 13.929 -2.414 -10.436 1.00 0.34 H new ATOM 0 HB2 GLU A 158 11.539 -0.532 -10.446 1.00 0.39 H new ATOM 0 HB3 GLU A 158 13.106 -0.203 -11.158 1.00 0.39 H new ATOM 0 HG2 GLU A 158 11.007 -2.178 -12.064 1.00 0.61 H new ATOM 0 HG3 GLU A 158 11.723 -0.856 -12.965 1.00 0.61 H new ATOM 2703 N LEU A 159 12.561 -1.166 -7.739 1.00 0.25 N ATOM 2704 CA LEU A 159 12.857 -0.522 -6.470 1.00 0.23 C ATOM 2705 C LEU A 159 13.957 -1.286 -5.746 1.00 0.22 C ATOM 2706 O LEU A 159 14.975 -0.710 -5.362 1.00 0.22 O ATOM 2707 CB LEU A 159 11.599 -0.431 -5.591 1.00 0.21 C ATOM 2708 CG LEU A 159 11.867 -0.454 -4.092 1.00 0.55 C ATOM 2709 CD1 LEU A 159 12.477 0.862 -3.656 1.00 0.86 C ATOM 2710 CD2 LEU A 159 10.590 -0.742 -3.325 1.00 0.66 C ATOM 0 H LEU A 159 11.607 -1.516 -7.822 1.00 0.25 H new ATOM 0 HA LEU A 159 13.200 0.493 -6.670 1.00 0.23 H new ATOM 0 HB2 LEU A 159 11.066 0.488 -5.837 1.00 0.21 H new ATOM 0 HB3 LEU A 159 10.937 -1.260 -5.841 1.00 0.21 H new ATOM 0 HG LEU A 159 12.575 -1.253 -3.872 1.00 0.55 H new ATOM 0 HD11 LEU A 159 12.666 0.838 -2.583 1.00 0.86 H new ATOM 0 HD12 LEU A 159 13.416 1.021 -4.186 1.00 0.86 H new ATOM 0 HD13 LEU A 159 11.789 1.676 -3.885 1.00 0.86 H new ATOM 0 HD21 LEU A 159 10.803 -0.754 -2.256 1.00 0.66 H new ATOM 0 HD22 LEU A 159 9.854 0.033 -3.540 1.00 0.66 H new ATOM 0 HD23 LEU A 159 10.195 -1.712 -3.627 1.00 0.66 H new ATOM 2722 N ILE A 160 13.750 -2.586 -5.575 1.00 0.24 N ATOM 2723 CA ILE A 160 14.725 -3.435 -4.903 1.00 0.26 C ATOM 2724 C ILE A 160 16.058 -3.418 -5.650 1.00 0.27 C ATOM 2725 O ILE A 160 17.129 -3.478 -5.038 1.00 0.28 O ATOM 2726 CB ILE A 160 14.204 -4.876 -4.759 1.00 0.30 C ATOM 2727 CG1 ILE A 160 12.804 -4.859 -4.140 1.00 0.28 C ATOM 2728 CG2 ILE A 160 15.154 -5.692 -3.897 1.00 0.40 C ATOM 2729 CD1 ILE A 160 11.908 -5.984 -4.607 1.00 0.37 C ATOM 0 H ILE A 160 12.914 -3.076 -5.893 1.00 0.24 H new ATOM 0 HA ILE A 160 14.883 -3.035 -3.902 1.00 0.26 H new ATOM 0 HB ILE A 160 14.149 -5.337 -5.745 1.00 0.30 H new ATOM 0 HG12 ILE A 160 12.898 -4.910 -3.055 1.00 0.28 H new ATOM 0 HG13 ILE A 160 12.326 -3.908 -4.374 1.00 0.28 H new ATOM 0 HG21 ILE A 160 14.776 -6.710 -3.802 1.00 0.40 H new ATOM 0 HG22 ILE A 160 16.140 -5.713 -4.362 1.00 0.40 H new ATOM 0 HG23 ILE A 160 15.229 -5.239 -2.909 1.00 0.40 H new ATOM 0 HD11 ILE A 160 10.935 -5.900 -4.122 1.00 0.37 H new ATOM 0 HD12 ILE A 160 11.781 -5.923 -5.688 1.00 0.37 H new ATOM 0 HD13 ILE A 160 12.361 -6.941 -4.348 1.00 0.37 H new ATOM 2741 N LYS A 161 15.983 -3.321 -6.976 1.00 0.29 N ATOM 2742 CA LYS A 161 17.181 -3.249 -7.807 1.00 0.32 C ATOM 2743 C LYS A 161 17.980 -2.001 -7.446 1.00 0.29 C ATOM 2744 O LYS A 161 19.209 -2.038 -7.353 1.00 0.32 O ATOM 2745 CB LYS A 161 16.812 -3.217 -9.291 1.00 0.36 C ATOM 2746 CG LYS A 161 16.458 -4.580 -9.865 1.00 0.96 C ATOM 2747 CD LYS A 161 15.840 -4.465 -11.254 1.00 1.15 C ATOM 2748 CE LYS A 161 16.805 -3.862 -12.267 1.00 1.50 C ATOM 2749 NZ LYS A 161 16.437 -2.465 -12.629 1.00 2.13 N ATOM 0 H LYS A 161 15.106 -3.291 -7.496 1.00 0.29 H new ATOM 0 HA LYS A 161 17.786 -4.137 -7.622 1.00 0.32 H new ATOM 0 HB2 LYS A 161 15.967 -2.543 -9.431 1.00 0.36 H new ATOM 0 HB3 LYS A 161 17.647 -2.802 -9.855 1.00 0.36 H new ATOM 0 HG2 LYS A 161 17.355 -5.197 -9.916 1.00 0.96 H new ATOM 0 HG3 LYS A 161 15.761 -5.086 -9.197 1.00 0.96 H new ATOM 0 HD2 LYS A 161 15.530 -5.453 -11.594 1.00 1.15 H new ATOM 0 HD3 LYS A 161 14.942 -3.850 -11.200 1.00 1.15 H new ATOM 0 HE2 LYS A 161 17.815 -3.876 -11.857 1.00 1.50 H new ATOM 0 HE3 LYS A 161 16.817 -4.478 -13.166 1.00 1.50 H new ATOM 0 HZ1 LYS A 161 16.999 -2.159 -13.449 1.00 2.13 H new ATOM 0 HZ2 LYS A 161 15.426 -2.423 -12.868 1.00 2.13 H new ATOM 0 HZ3 LYS A 161 16.629 -1.836 -11.824 1.00 2.13 H new ATOM 2763 N GLU A 162 17.260 -0.900 -7.229 1.00 0.27 N ATOM 2764 CA GLU A 162 17.872 0.370 -6.856 1.00 0.27 C ATOM 2765 C GLU A 162 18.540 0.265 -5.485 1.00 0.27 C ATOM 2766 O GLU A 162 19.593 0.852 -5.251 1.00 0.30 O ATOM 2767 CB GLU A 162 16.812 1.475 -6.843 1.00 0.29 C ATOM 2768 CG GLU A 162 17.344 2.848 -6.460 1.00 0.41 C ATOM 2769 CD GLU A 162 18.143 3.497 -7.569 1.00 0.56 C ATOM 2770 OE1 GLU A 162 17.541 3.874 -8.597 1.00 1.17 O ATOM 2771 OE2 GLU A 162 19.377 3.634 -7.422 1.00 1.34 O ATOM 0 H GLU A 162 16.244 -0.866 -7.307 1.00 0.27 H new ATOM 0 HA GLU A 162 18.637 0.617 -7.592 1.00 0.27 H new ATOM 0 HB2 GLU A 162 16.357 1.537 -7.831 1.00 0.29 H new ATOM 0 HB3 GLU A 162 16.022 1.197 -6.145 1.00 0.29 H new ATOM 0 HG2 GLU A 162 16.508 3.495 -6.194 1.00 0.41 H new ATOM 0 HG3 GLU A 162 17.971 2.755 -5.573 1.00 0.41 H new ATOM 2778 N LEU A 163 17.930 -0.502 -4.587 1.00 0.28 N ATOM 2779 CA LEU A 163 18.461 -0.681 -3.235 1.00 0.33 C ATOM 2780 C LEU A 163 19.780 -1.443 -3.243 1.00 0.27 C ATOM 2781 O LEU A 163 20.500 -1.451 -2.249 1.00 0.27 O ATOM 2782 CB LEU A 163 17.464 -1.439 -2.355 1.00 0.48 C ATOM 2783 CG LEU A 163 16.009 -1.010 -2.502 1.00 0.38 C ATOM 2784 CD1 LEU A 163 15.106 -1.888 -1.650 1.00 0.80 C ATOM 2785 CD2 LEU A 163 15.840 0.450 -2.119 1.00 0.58 C ATOM 0 H LEU A 163 17.065 -1.012 -4.769 1.00 0.28 H new ATOM 0 HA LEU A 163 18.630 0.317 -2.830 1.00 0.33 H new ATOM 0 HB2 LEU A 163 17.537 -2.502 -2.584 1.00 0.48 H new ATOM 0 HB3 LEU A 163 17.758 -1.317 -1.313 1.00 0.48 H new ATOM 0 HG LEU A 163 15.722 -1.128 -3.547 1.00 0.38 H new ATOM 0 HD11 LEU A 163 14.071 -1.567 -1.767 1.00 0.80 H new ATOM 0 HD12 LEU A 163 15.203 -2.926 -1.968 1.00 0.80 H new ATOM 0 HD13 LEU A 163 15.396 -1.801 -0.603 1.00 0.80 H new ATOM 0 HD21 LEU A 163 14.794 0.737 -2.231 1.00 0.58 H new ATOM 0 HD22 LEU A 163 16.146 0.592 -1.083 1.00 0.58 H new ATOM 0 HD23 LEU A 163 16.458 1.070 -2.768 1.00 0.58 H new ATOM 2797 N GLY A 164 20.103 -2.071 -4.365 1.00 0.26 N ATOM 2798 CA GLY A 164 21.328 -2.833 -4.445 1.00 0.26 C ATOM 2799 C GLY A 164 21.155 -4.207 -3.852 1.00 0.25 C ATOM 2800 O GLY A 164 22.129 -4.873 -3.500 1.00 0.32 O ATOM 0 H GLY A 164 19.541 -2.066 -5.216 1.00 0.26 H new ATOM 0 HA2 GLY A 164 21.638 -2.920 -5.486 1.00 0.26 H new ATOM 0 HA3 GLY A 164 22.123 -2.305 -3.919 1.00 0.26 H new ATOM 2804 N PHE A 165 19.909 -4.641 -3.759 1.00 0.23 N ATOM 2805 CA PHE A 165 19.603 -5.937 -3.193 1.00 0.24 C ATOM 2806 C PHE A 165 18.899 -6.826 -4.210 1.00 0.25 C ATOM 2807 O PHE A 165 18.667 -6.427 -5.352 1.00 0.27 O ATOM 2808 CB PHE A 165 18.733 -5.773 -1.948 1.00 0.24 C ATOM 2809 CG PHE A 165 19.208 -6.574 -0.770 1.00 0.28 C ATOM 2810 CD1 PHE A 165 20.242 -6.108 0.024 1.00 0.34 C ATOM 2811 CD2 PHE A 165 18.620 -7.788 -0.453 1.00 0.30 C ATOM 2812 CE1 PHE A 165 20.682 -6.836 1.110 1.00 0.41 C ATOM 2813 CE2 PHE A 165 19.056 -8.522 0.632 1.00 0.37 C ATOM 2814 CZ PHE A 165 20.088 -8.045 1.414 1.00 0.41 C ATOM 0 H PHE A 165 19.094 -4.111 -4.070 1.00 0.23 H new ATOM 0 HA PHE A 165 20.541 -6.417 -2.914 1.00 0.24 H new ATOM 0 HB2 PHE A 165 18.705 -4.719 -1.672 1.00 0.24 H new ATOM 0 HB3 PHE A 165 17.711 -6.067 -2.188 1.00 0.24 H new ATOM 0 HD1 PHE A 165 20.710 -5.163 -0.210 1.00 0.34 H new ATOM 0 HD2 PHE A 165 17.811 -8.164 -1.062 1.00 0.30 H new ATOM 0 HE1 PHE A 165 21.490 -6.461 1.721 1.00 0.41 H new ATOM 0 HE2 PHE A 165 18.590 -9.467 0.868 1.00 0.37 H new ATOM 0 HZ PHE A 165 20.431 -8.617 2.263 1.00 0.41 H new ATOM 2824 N THR A 166 18.563 -8.028 -3.779 1.00 0.28 N ATOM 2825 CA THR A 166 17.886 -8.988 -4.630 1.00 0.32 C ATOM 2826 C THR A 166 16.375 -8.916 -4.401 1.00 0.28 C ATOM 2827 O THR A 166 15.913 -8.721 -3.273 1.00 0.29 O ATOM 2828 CB THR A 166 18.415 -10.421 -4.378 1.00 0.42 C ATOM 2829 OG1 THR A 166 17.919 -11.323 -5.375 1.00 1.37 O ATOM 2830 CG2 THR A 166 18.031 -10.922 -2.991 1.00 1.15 C ATOM 0 H THR A 166 18.751 -8.365 -2.835 1.00 0.28 H new ATOM 0 HA THR A 166 18.093 -8.737 -5.670 1.00 0.32 H new ATOM 0 HB THR A 166 19.503 -10.383 -4.438 1.00 0.42 H new ATOM 0 HG1 THR A 166 18.488 -12.120 -5.407 1.00 1.37 H new ATOM 0 HG21 THR A 166 18.419 -11.931 -2.848 1.00 1.15 H new ATOM 0 HG22 THR A 166 18.454 -10.260 -2.235 1.00 1.15 H new ATOM 0 HG23 THR A 166 16.945 -10.934 -2.896 1.00 1.15 H new ATOM 2838 N TYR A 167 15.608 -9.045 -5.475 1.00 0.35 N ATOM 2839 CA TYR A 167 14.156 -8.978 -5.384 1.00 0.41 C ATOM 2840 C TYR A 167 13.552 -10.366 -5.212 1.00 0.42 C ATOM 2841 O TYR A 167 14.224 -11.380 -5.416 1.00 0.44 O ATOM 2842 CB TYR A 167 13.567 -8.288 -6.623 1.00 0.51 C ATOM 2843 CG TYR A 167 13.845 -9.000 -7.928 1.00 0.55 C ATOM 2844 CD1 TYR A 167 14.985 -8.715 -8.668 1.00 1.22 C ATOM 2845 CD2 TYR A 167 12.965 -9.955 -8.420 1.00 1.46 C ATOM 2846 CE1 TYR A 167 15.242 -9.363 -9.859 1.00 1.28 C ATOM 2847 CE2 TYR A 167 13.215 -10.607 -9.611 1.00 1.60 C ATOM 2848 CZ TYR A 167 14.354 -10.309 -10.327 1.00 0.94 C ATOM 2849 OH TYR A 167 14.608 -10.962 -11.511 1.00 1.18 O ATOM 0 H TYR A 167 15.966 -9.196 -6.418 1.00 0.35 H new ATOM 0 HA TYR A 167 13.903 -8.387 -4.504 1.00 0.41 H new ATOM 0 HB2 TYR A 167 12.488 -8.198 -6.495 1.00 0.51 H new ATOM 0 HB3 TYR A 167 13.966 -7.275 -6.684 1.00 0.51 H new ATOM 0 HD1 TYR A 167 15.682 -7.974 -8.305 1.00 1.22 H new ATOM 0 HD2 TYR A 167 12.071 -10.191 -7.862 1.00 1.46 H new ATOM 0 HE1 TYR A 167 16.134 -9.131 -10.422 1.00 1.28 H new ATOM 0 HE2 TYR A 167 12.521 -11.347 -9.980 1.00 1.60 H new ATOM 0 HH TYR A 167 13.885 -11.597 -11.696 1.00 1.18 H new ATOM 2859 N ARG A 168 12.283 -10.403 -4.838 1.00 0.48 N ATOM 2860 CA ARG A 168 11.573 -11.656 -4.633 1.00 0.54 C ATOM 2861 C ARG A 168 10.162 -11.560 -5.195 1.00 0.57 C ATOM 2862 O ARG A 168 9.799 -10.559 -5.809 1.00 0.81 O ATOM 2863 CB ARG A 168 11.511 -12.007 -3.141 1.00 0.61 C ATOM 2864 CG ARG A 168 12.824 -12.522 -2.569 1.00 0.89 C ATOM 2865 CD ARG A 168 13.302 -13.767 -3.296 1.00 1.36 C ATOM 2866 NE ARG A 168 14.515 -14.322 -2.699 1.00 1.90 N ATOM 2867 CZ ARG A 168 15.750 -14.028 -3.105 1.00 2.59 C ATOM 2868 NH1 ARG A 168 15.943 -13.145 -4.084 1.00 3.05 N ATOM 2869 NH2 ARG A 168 16.793 -14.617 -2.529 1.00 3.19 N ATOM 0 H ARG A 168 11.718 -9.570 -4.669 1.00 0.48 H new ATOM 0 HA ARG A 168 12.116 -12.443 -5.156 1.00 0.54 H new ATOM 0 HB2 ARG A 168 11.206 -11.122 -2.583 1.00 0.61 H new ATOM 0 HB3 ARG A 168 10.739 -12.762 -2.988 1.00 0.61 H new ATOM 0 HG2 ARG A 168 13.583 -11.743 -2.642 1.00 0.89 H new ATOM 0 HG3 ARG A 168 12.697 -12.745 -1.510 1.00 0.89 H new ATOM 0 HD2 ARG A 168 12.514 -14.520 -3.281 1.00 1.36 H new ATOM 0 HD3 ARG A 168 13.491 -13.525 -4.342 1.00 1.36 H new ATOM 0 HE ARG A 168 14.410 -14.975 -1.923 1.00 1.90 H new ATOM 0 HH11 ARG A 168 15.144 -12.691 -4.526 1.00 3.05 H new ATOM 0 HH12 ARG A 168 16.890 -12.923 -4.391 1.00 3.05 H new ATOM 0 HH21 ARG A 168 16.647 -15.292 -1.778 1.00 3.19 H new ATOM 0 HH22 ARG A 168 17.739 -14.394 -2.838 1.00 3.19 H new ATOM 2883 N ILE A 169 9.384 -12.612 -4.997 1.00 0.50 N ATOM 2884 CA ILE A 169 8.007 -12.650 -5.465 1.00 0.54 C ATOM 2885 C ILE A 169 7.066 -12.110 -4.386 1.00 0.47 C ATOM 2886 O ILE A 169 7.280 -12.355 -3.197 1.00 0.50 O ATOM 2887 CB ILE A 169 7.586 -14.083 -5.859 1.00 0.65 C ATOM 2888 CG1 ILE A 169 8.108 -15.100 -4.834 1.00 0.73 C ATOM 2889 CG2 ILE A 169 8.096 -14.414 -7.256 1.00 0.96 C ATOM 2890 CD1 ILE A 169 7.755 -16.536 -5.159 1.00 0.98 C ATOM 0 H ILE A 169 9.685 -13.457 -4.512 1.00 0.50 H new ATOM 0 HA ILE A 169 7.939 -12.020 -6.352 1.00 0.54 H new ATOM 0 HB ILE A 169 6.497 -14.138 -5.866 1.00 0.65 H new ATOM 0 HG12 ILE A 169 9.192 -15.009 -4.767 1.00 0.73 H new ATOM 0 HG13 ILE A 169 7.706 -14.851 -3.852 1.00 0.73 H new ATOM 0 HG21 ILE A 169 7.793 -15.426 -7.523 1.00 0.96 H new ATOM 0 HG22 ILE A 169 7.676 -13.709 -7.973 1.00 0.96 H new ATOM 0 HG23 ILE A 169 9.184 -14.344 -7.272 1.00 0.96 H new ATOM 0 HD11 ILE A 169 8.159 -17.193 -4.389 1.00 0.98 H new ATOM 0 HD12 ILE A 169 6.671 -16.645 -5.197 1.00 0.98 H new ATOM 0 HD13 ILE A 169 8.181 -16.806 -6.126 1.00 0.98 H new ATOM 2902 N PRO A 170 6.006 -11.384 -4.783 1.00 0.46 N ATOM 2903 CA PRO A 170 5.045 -10.792 -3.838 1.00 0.44 C ATOM 2904 C PRO A 170 4.274 -11.837 -3.038 1.00 0.39 C ATOM 2905 O PRO A 170 3.755 -11.556 -1.955 1.00 0.43 O ATOM 2906 CB PRO A 170 4.087 -10.012 -4.740 1.00 0.51 C ATOM 2907 CG PRO A 170 4.221 -10.651 -6.081 1.00 0.56 C ATOM 2908 CD PRO A 170 5.659 -11.072 -6.181 1.00 0.54 C ATOM 0 HA PRO A 170 5.551 -10.182 -3.090 1.00 0.44 H new ATOM 0 HB2 PRO A 170 3.062 -10.072 -4.374 1.00 0.51 H new ATOM 0 HB3 PRO A 170 4.351 -8.955 -4.777 1.00 0.51 H new ATOM 0 HG2 PRO A 170 3.553 -11.507 -6.176 1.00 0.56 H new ATOM 0 HG3 PRO A 170 3.960 -9.953 -6.877 1.00 0.56 H new ATOM 0 HD2 PRO A 170 5.783 -11.938 -6.831 1.00 0.54 H new ATOM 0 HD3 PRO A 170 6.286 -10.277 -6.586 1.00 0.54 H new ATOM 2916 N LYS A 171 4.218 -13.047 -3.570 1.00 0.38 N ATOM 2917 CA LYS A 171 3.513 -14.145 -2.921 1.00 0.43 C ATOM 2918 C LYS A 171 4.340 -14.746 -1.788 1.00 0.50 C ATOM 2919 O LYS A 171 3.941 -15.735 -1.176 1.00 0.57 O ATOM 2920 CB LYS A 171 3.132 -15.225 -3.943 1.00 0.50 C ATOM 2921 CG LYS A 171 4.315 -15.886 -4.629 1.00 1.43 C ATOM 2922 CD LYS A 171 3.875 -16.757 -5.800 1.00 1.73 C ATOM 2923 CE LYS A 171 3.111 -17.990 -5.336 1.00 2.23 C ATOM 2924 NZ LYS A 171 2.623 -18.804 -6.482 1.00 2.51 N ATOM 0 H LYS A 171 4.656 -13.297 -4.457 1.00 0.38 H new ATOM 0 HA LYS A 171 2.599 -13.740 -2.487 1.00 0.43 H new ATOM 0 HB2 LYS A 171 2.544 -15.993 -3.440 1.00 0.50 H new ATOM 0 HB3 LYS A 171 2.490 -14.779 -4.703 1.00 0.50 H new ATOM 0 HG2 LYS A 171 5.004 -15.120 -4.984 1.00 1.43 H new ATOM 0 HG3 LYS A 171 4.860 -16.495 -3.908 1.00 1.43 H new ATOM 0 HD2 LYS A 171 3.246 -16.172 -6.471 1.00 1.73 H new ATOM 0 HD3 LYS A 171 4.750 -17.066 -6.371 1.00 1.73 H new ATOM 0 HE2 LYS A 171 3.757 -18.601 -4.705 1.00 2.23 H new ATOM 0 HE3 LYS A 171 2.264 -17.683 -4.722 1.00 2.23 H new ATOM 0 HZ1 LYS A 171 2.108 -19.634 -6.124 1.00 2.51 H new ATOM 0 HZ2 LYS A 171 1.987 -18.229 -7.070 1.00 2.51 H new ATOM 0 HZ3 LYS A 171 3.433 -19.119 -7.054 1.00 2.51 H new ATOM 2938 N LYS A 172 5.492 -14.148 -1.510 1.00 0.62 N ATOM 2939 CA LYS A 172 6.354 -14.646 -0.446 1.00 0.74 C ATOM 2940 C LYS A 172 5.946 -14.069 0.913 1.00 0.58 C ATOM 2941 O LYS A 172 5.845 -14.809 1.888 1.00 0.64 O ATOM 2942 CB LYS A 172 7.813 -14.293 -0.754 1.00 1.09 C ATOM 2943 CG LYS A 172 8.818 -15.350 -0.321 1.00 1.53 C ATOM 2944 CD LYS A 172 8.956 -15.415 1.192 1.00 1.82 C ATOM 2945 CE LYS A 172 8.436 -16.732 1.743 1.00 2.39 C ATOM 2946 NZ LYS A 172 9.358 -17.853 1.452 1.00 2.96 N ATOM 0 H LYS A 172 5.848 -13.327 -2.000 1.00 0.62 H new ATOM 0 HA LYS A 172 6.246 -15.730 -0.396 1.00 0.74 H new ATOM 0 HB2 LYS A 172 7.916 -14.128 -1.827 1.00 1.09 H new ATOM 0 HB3 LYS A 172 8.058 -13.352 -0.262 1.00 1.09 H new ATOM 0 HG2 LYS A 172 8.507 -16.324 -0.699 1.00 1.53 H new ATOM 0 HG3 LYS A 172 9.789 -15.131 -0.765 1.00 1.53 H new ATOM 0 HD2 LYS A 172 10.003 -15.292 1.468 1.00 1.82 H new ATOM 0 HD3 LYS A 172 8.408 -14.589 1.644 1.00 1.82 H new ATOM 0 HE2 LYS A 172 8.298 -16.646 2.821 1.00 2.39 H new ATOM 0 HE3 LYS A 172 7.458 -16.945 1.312 1.00 2.39 H new ATOM 0 HZ1 LYS A 172 8.968 -18.734 1.844 1.00 2.96 H new ATOM 0 HZ2 LYS A 172 9.470 -17.952 0.423 1.00 2.96 H new ATOM 0 HZ3 LYS A 172 10.284 -17.662 1.885 1.00 2.96 H new ATOM 2960 N ARG A 173 5.646 -12.767 0.938 1.00 0.56 N ATOM 2961 CA ARG A 173 5.251 -12.042 2.159 1.00 0.65 C ATOM 2962 C ARG A 173 6.028 -12.482 3.412 1.00 0.87 C ATOM 2963 O ARG A 173 5.553 -13.306 4.199 1.00 1.49 O ATOM 2964 CB ARG A 173 3.736 -12.146 2.414 1.00 0.64 C ATOM 2965 CG ARG A 173 3.291 -11.457 3.705 1.00 1.35 C ATOM 2966 CD ARG A 173 1.782 -11.275 3.791 1.00 1.61 C ATOM 2967 NE ARG A 173 1.382 -9.881 3.580 1.00 2.41 N ATOM 2968 CZ ARG A 173 0.115 -9.455 3.595 1.00 3.10 C ATOM 2969 NH1 ARG A 173 -0.881 -10.315 3.789 1.00 3.34 N ATOM 2970 NH2 ARG A 173 -0.153 -8.164 3.430 1.00 4.00 N ATOM 0 H ARG A 173 5.669 -12.177 0.106 1.00 0.56 H new ATOM 0 HA ARG A 173 5.511 -11.000 1.972 1.00 0.65 H new ATOM 0 HB2 ARG A 173 3.202 -11.705 1.572 1.00 0.64 H new ATOM 0 HB3 ARG A 173 3.453 -13.198 2.455 1.00 0.64 H new ATOM 0 HG2 ARG A 173 3.630 -12.043 4.559 1.00 1.35 H new ATOM 0 HG3 ARG A 173 3.774 -10.482 3.775 1.00 1.35 H new ATOM 0 HD2 ARG A 173 1.298 -11.907 3.047 1.00 1.61 H new ATOM 0 HD3 ARG A 173 1.432 -11.608 4.768 1.00 1.61 H new ATOM 0 HE ARG A 173 2.116 -9.193 3.411 1.00 2.41 H new ATOM 0 HH11 ARG A 173 -0.680 -11.305 3.927 1.00 3.34 H new ATOM 0 HH12 ARG A 173 -1.846 -9.984 3.799 1.00 3.34 H new ATOM 0 HH21 ARG A 173 0.608 -7.499 3.292 1.00 4.00 H new ATOM 0 HH22 ARG A 173 -1.120 -7.838 3.441 1.00 4.00 H new ATOM 2984 N LEU A 174 7.222 -11.935 3.593 1.00 0.50 N ATOM 2985 CA LEU A 174 8.035 -12.247 4.760 1.00 0.68 C ATOM 2986 C LEU A 174 8.762 -11.000 5.231 1.00 1.39 C ATOM 2987 O LEU A 174 9.593 -10.488 4.470 1.00 2.08 O ATOM 2988 CB LEU A 174 9.033 -13.359 4.446 1.00 1.19 C ATOM 2989 CG LEU A 174 9.024 -14.546 5.419 1.00 1.76 C ATOM 2990 CD1 LEU A 174 10.028 -15.600 4.985 1.00 2.44 C ATOM 2991 CD2 LEU A 174 9.326 -14.087 6.838 1.00 2.36 C ATOM 2992 OXT LEU A 174 8.481 -10.530 6.354 1.00 2.14 O ATOM 0 H LEU A 174 7.649 -11.272 2.946 1.00 0.50 H new ATOM 0 HA LEU A 174 7.379 -12.598 5.556 1.00 0.68 H new ATOM 0 HB2 LEU A 174 8.831 -13.732 3.442 1.00 1.19 H new ATOM 0 HB3 LEU A 174 10.035 -12.931 4.431 1.00 1.19 H new ATOM 0 HG LEU A 174 8.027 -14.985 5.404 1.00 1.76 H new ATOM 0 HD11 LEU A 174 10.007 -16.433 5.687 1.00 2.44 H new ATOM 0 HD12 LEU A 174 9.771 -15.959 3.988 1.00 2.44 H new ATOM 0 HD13 LEU A 174 11.027 -15.165 4.968 1.00 2.44 H new ATOM 0 HD21 LEU A 174 9.314 -14.946 7.509 1.00 2.36 H new ATOM 0 HD22 LEU A 174 10.309 -13.618 6.867 1.00 2.36 H new ATOM 0 HD23 LEU A 174 8.571 -13.368 7.156 1.00 2.36 H new